"ChEMBL ID"	"Name"	"Synonyms"	"Type"	"Max Phase"	"Molecular Weight"	"Targets"	"Bioactivities"	"AlogP"	"Polar Surface Area"	"HBA"	"HBD"	"#RO5 Violations"	"#Rotatable Bonds"	"Passes Ro3"	"QED Weighted"	"CX Acidic pKa"	"CX Basic pKa"	"CX LogP"	"CX LogD"	"Aromatic Rings"	"Structure Type"	"Inorganic Flag"	"Heavy Atoms"	"HBA (Lipinski)"	"HBD (Lipinski)"	"#RO5 Violations (Lipinski)"	"Molecular Weight (Monoisotopic)"	"Molecular Species"	"Molecular Formula"	"Smiles"
"CHEMBL4650249"	"IMDEVIMAB"	"IMDEVIMAB|REGN-10987|REGN10987"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL198362"	"RIVAROXABAN"	"BAY 59-7939|BAY-59-7939|JNJ-39039039|JNJ39039039|RIVAROXABAN|Xarelto"	"Small molecule"	"4"	"435.89"	"25"	"158"	"2.52"	"88.18"	"6"	"1"	"0"	"5"	"N"	"0.78"	"13.60"	"None"	"1.90"	"1.90"	"2"	"MOL"	"0"	"29"	"8"	"1"	"0"	"435.0656"	"NEUTRAL"	"C19H18ClN3O5S"	"O=C(NC[C@H]1CN(c2ccc(N3CCOCC3=O)cc2)C(=O)O1)c1ccc(Cl)s1"
"CHEMBL1201570"	"ANAKINRA"	"ALTA-2530|ALTA2530|AMG-719|ANAKINRA|Antril|INTERLEUKIN-1 RECEPTOR ANTAGONIST ANAKINRA|KINERET|OSP-101"	"Protein"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1873475"	"IBRUTINIB"	"CRA-032765|IBRUTINIB|IMBRUVICA|PC-32765|PCI 32765|PCI-32765|PCI-32765-00"	"Small molecule"	"4"	"440.51"	"374"	"1026"	"4.22"	"99.16"	"7"	"1"	"0"	"5"	"N"	"0.47"	"None"	"4.06"	"3.63"	"3.63"	"4"	"MOL"	"0"	"33"	"8"	"2"	"0"	"440.1961"	"NEUTRAL"	"C25H24N6O2"	"C=CC(=O)N1CCC[C@@H](n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)C1"
"CHEMBL1069"	"VALSARTAN"	"CGP 48933|CGP-48933|Diovan|Exforge|NSC-758927|PREXXARTAN|VALSARTAN"	"Small molecule"	"4"	"435.53"	"148"	"1142"	"4.16"	"112.07"	"5"	"2"	"0"	"10"	"N"	"0.49"	"4.00"	"None"	"4.59"	"0.08"	"3"	"MOL"	"0"	"32"	"8"	"2"	"0"	"435.2270"	"ACID"	"C24H29N5O3"	"CCCCC(=O)N(Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1)[C@H](C(=O)O)C(C)C"
"CHEMBL1201562"	"INTERFERON BETA-1A"	"AVONEX|INTERFERON BETA-1A|Neoferon|REBIF|SNG-001|SNG001"	"Protein"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1016"	"CANDESARTAN"	"CANDESARTAN|CANDESARTAN CILEXETIL RELATED COMPOUND G|CV-11974|Candesartan|NSC-759858"	"Small molecule"	"3"	"440.46"	"134"	"979"	"4.03"	"118.81"	"7"	"2"	"0"	"7"	"N"	"0.39"	"3.44"	"1.50"	"4.68"	"-0.30"	"5"	"MOL"	"0"	"33"	"9"	"2"	"0"	"440.1597"	"ACID"	"C24H20N6O3"	"CCOc1nc2cccc(C(=O)O)c2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1"
"CHEMBL4297865"	"ABIVERTINIB"	"A610|ABIVERTINIB|AC-0010|AC0010|ACEA100610|AVITINIB|EX-ACEA0010"	"Small molecule"	"3"	"487.54"	"3"	"6"	"4.51"	"98.41"	"7"	"3"	"0"	"7"	"N"	"0.33"	"12.60"	"7.25"	"4.82"	"4.59"	"4"	"MOL"	"0"	"36"	"9"	"3"	"0"	"487.2132"	"NEUTRAL"	"C26H26FN7O2"	"C=CC(=O)Nc1cccc(Oc2nc(Nc3ccc(N4CCN(C)CC4)c(F)c3)nc3[nH]ccc23)c1"
"CHEMBL2397415"	"ZAVEGEPANT"	"BHV-3500|BMS-742413|BMS-742413-01|VAZEGEPANT|ZAVEGEPANT"	"Small molecule"	"3"	"638.82"	"19"	"50"	"3.45"	"120.67"	"6"	"3"	"1"	"6"	"N"	"0.30"	"12.38"	"8.78"	"2.14"	"0.71"	"4"	"MOL"	"0"	"47"	"11"	"3"	"2"	"638.3693"	"BASE"	"C36H46N8O3"	"Cc1cc(C[C@@H](NC(=O)N2CCC(c3cc4ccccc4[nH]c3=O)CC2)C(=O)N2CCN(C3CCN(C)CC3)CC2)cc2cn[nH]c12"
"CHEMBL1200973"	"ESTRADIOL CYPIONATE"	"DEPO-ESTRADIOL|Depo|ESTRADIOL 17.BETA.-CYCLOPENTANEPROPANOATE|ESTRADIOL CIPIONATE|ESTRADIOL CYPIONATE|NSC-3354"	"Small molecule"	"4"	"396.57"	"76"	"114"	"6.13"	"46.53"	"3"	"1"	"1"	"4"	"N"	"0.62"	"10.33"	"None"	"6.49"	"6.49"	"1"	"MOL"	"0"	"29"	"3"	"1"	"1"	"396.2664"	"NEUTRAL"	"C26H36O3"	"C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2OC(=O)CCC1CCCC1"
"CHEMBL4802187"	"ADINTREVIMAB"	"ADG-20|ADG20|ADINTREVIMAB"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1200699"	"DOXYCYCLINE"	"DOXIROBE|DOXYCHEL|DOXYCYCLINE|DOXYCYCLINE MONOHYDRATE|DOXYLIN|GS-3065|MONODOX|ORACEA|SUPRACYCLIN|Vibramycin|XYROSA"	"Small molecule"	"4"	"462.46"	""	""	"-0.35"	"181.62"	"9"	"6"	"1"	"2"	"N"	"0.33"	"2.92"	"7.46"	"-3.29"	"-3.57"	"1"	"MOL"	"0"	"32"	"10"	"7"	"1"	"444.1533"	"ACID"	"C22H26N2O9"	"C[C@H]1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@@H]3[C@@H](O)[C@@H]21.O"
"CHEMBL4594385"	"ASTEGOLIMAB"	"AMG-282|AMG282|ASTEGOLIMAB|MSTT-1041A|MSTT1041A|RG-6149|RG6149|RO-7187807"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL3809489"	"BEMCENTINIB"	"BEMCENTINIB|BGB 324|BGB-324|BGB324|CS-1046|HY-15150|KB-80319|QC-11751|R 428|R-428|R428|SYN-1131|SYN1131|W-5845"	"Small molecule"	"2"	"506.66"	"25"	"48"	"4.88"	"97.78"	"8"	"2"	"1"	"4"	"N"	"0.38"	"11.70"	"10.55"	"6.19"	"3.40"	"4"	"MOL"	"0"	"38"	"8"	"3"	"1"	"506.2906"	"BASE"	"C30H34N8"	"Nc1nc(Nc2ccc3c(c2)CC[C@@H](N2CCCC2)CC3)nn1-c1cc2c(nn1)-c1ccccc1CCC2"
"CHEMBL2109636"	"VILOBELIMAB"	"CACP 29|CACP29|IFX-1|VILOBELIMAB"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL50"	"QUERCETIN"	"3'-HYDROXYKAEMPFEROL|C.I. 75670|C.I. Natural Red 1|CI-75670|CORVITIN|CYANIDENOLON 1522|KORVITIN|LDN 0052529|LDN-0052529|LIPOFLAVON|MELETIN|NSC 57655|NSC 9219|NSC-57655|NSC-9219|QUERCETIN|QUERCETINE|QUERCETOL|QUERTIN|QUERTINE|SOPHORETIN|XANTHAURINE"	"Small molecule"	"3"	"302.24"	"598"	"2544"	"1.99"	"131.36"	"7"	"5"	"0"	"1"	"N"	"0.43"	"6.38"	"None"	"2.16"	"1.00"	"3"	"MOL"	"0"	"22"	"7"	"5"	"0"	"302.0427"	"ACID"	"C15H10O7"	"O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12"
"CHEMBL4298195"	"NARSOPLIMAB"	"MASP-2 ANTIBODY|NARSOPLIMAB|OMS-721|OMS00620646|OMS620646|OMS721"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL3989480"	"MAGNESIUM CITRATE"	"CITRAMAG|MAG CIT|MAG DIASPORAL 300|MAGCIT|MAGNESIUM CITRATE|NSC-83517"	"Small molecule"	"4"	"451.11"	""	""	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"0"	"None"	"None"	"None"	"None"	"449.9622"	"None"	"C12H10Mg3O14"	"O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].O=C([O-])CC(O)(CC(=O)[O-])C(=O)[O-].[Mg+2].[Mg+2].[Mg+2]"
"CHEMBL4802208"	"PEGIPANERMIN"	"DN-TNF|INB-03|INB03|LIVNate|PEGIPANERMIN|Quellor|XENP-1595|XENP1595|XPRO-1595|XPRO1595|XPro|XPro1595"	"Protein"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL415606"	"DEGARELIX"	"DEGARELIX|FE200486 (AS ACETATE SALT)|FIRMAGON"	"Protein"	"4"	"1632.29"	"8"	"21"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"0"	"None"	"None"	"None"	"None"	"1630.7488"	"None"	"C82H103ClN18O16"	"CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccc(Cl)cc1)C(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(NC(=O)[C@@H]2CC(=O)NC(=O)N2)cc1)C(=O)N[C@H](Cc1ccc(NC(N)=O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(N)=O"
"CHEMBL4650375"	"AT-100"	"AT-100|AT100|RECOMBINANT SP-D"	"Unknown"	"1"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1201581"	"INFLIXIMAB"	"ABP 710|ABP-710|AVSOLA|BOW-015|BOW015|CT-P-13|CT-P13|INFIMAB|INFLECTRA|INFLIXIMAB|INFLIXIMAB (JANSSEN)|INFLIXIMAB (REMICADE)|INFLIXIMAB-ABDA|INFLIXIMAB-AXXQ|INFLIXIMAB-DYYB|INFLIXIMAB-HJMT|INFLIXIMAB-PFIZER|INFLIXIMAB-QBTX|IXIFI|NI-071|PF-06438179|REMICADE|REMSIMA|TA-650|ZESSLY|cA2"	"Antibody"	"4"	""	"2"	"19"	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4297821"	"RSLV-132"	"RSLV-132"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL163"	"RITONAVIR"	"A-84538|ABBOTT-84538|ABT-538|EMPETUS|NSC-693184|Norvir|RITOMUNE|RITONAVIR|RITONAVIR RELATED COMPOUNDS MIXTURE|RITONAVIRUM|RITOVIR|VIEKIRAX|VIRITON"	"Small molecule"	"4"	"720.96"	"200"	"1444"	"5.91"	"145.78"	"9"	"4"	"2"	"17"	"N"	"0.11"	"13.68"	"2.84"	"5.22"	"5.22"	"4"	"MOL"	"0"	"50"	"11"	"4"	"3"	"720.3128"	"NEUTRAL"	"C37H48N6O5S2"	"CC(C)c1nc(CN(C)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)OCc2cncs2)C(C)C)cs1"
"CHEMBL2108046"	"REMESTEMCEL-L"	"JR-0301|Prochymal|REMESTEMCEL|REMESTEMCEL-L"	"Cell"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4297243"	"EMIPLACEL"	"EMIPLACEL|PLX-PAD|PLXPAD"	"Cell"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1236970"	"ZINC ION"	"ZINC CATION|ZINC ION"	"Small molecule"	"3"	"65.39"	"1"	"1"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"1"	"None"	"None"	"None"	"None"	"63.9280"	"None"	"Zn+2"	"[Zn+2]"
"CHEMBL3936761"	"ZANUBRUTINIB"	"BGB-3111|BRUKINSA|ZANUBRUTINIB"	"Small molecule"	"4"	"471.56"	"39"	"139"	"4.22"	"102.48"	"6"	"2"	"0"	"6"	"N"	"0.52"	"13.81"	"2.68"	"3.42"	"3.42"	"3"	"MOL"	"0"	"35"	"8"	"3"	"0"	"471.2270"	"NEUTRAL"	"C27H29N5O3"	"C=CC(=O)N1CCC([C@@H]2CCNc3c(C(N)=O)c(-c4ccc(Oc5ccccc5)cc4)nn32)CC1"
"CHEMBL1201438"	"ALDESLEUKIN"	"ALDESLEUKIN|HUMAN INTERLEUKIN-2|HUMAN INTERLEUKIN-2 125-SERINE|ILT-101|ILT-101 (LOW DOSE IL-2)|INTERLEUKIN 2|INTERLEUKIN-2|INTERLEUKIN-2 ALDESLEUKIN|INTERLEUKIN-2(2-133),125-SER|Proleukin|RECOMBINANT INTERLEUKIN-2 HUMAN"	"Protein"	"4"	""	"2"	"19"	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4594463"	"AVDORALIMAB"	"ANTI-C5AR-215|AVDORALIMAB|IPH-5401|IPH5401|NN-8210|NNC-0215-0384"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL495"	"ALPROSTADIL"	"ALPROSTADIL|CAVERJECT IMPULSE|Caverject|Edex|NSC-165559|ONO-1608|PGE1|PROSTAGLANDIN E1|PROSTIN VR|PROSTIN VR PEDIATRIC|Prostin|U-10,136|U-10136|VIRIDAL 10|VIRIDAL 20|VIRIDAL 5|VIRIDAL DUO|VITAROS"	"Small molecule"	"4"	"354.49"	"66"	"204"	"3.48"	"94.83"	"4"	"3"	"0"	"13"	"N"	"0.35"	"4.35"	"None"	"3.59"	"0.66"	"0"	"MOL"	"0"	"25"	"5"	"3"	"0"	"354.2406"	"ACID"	"C20H34O5"	"CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O"
"CHEMBL2009089"	"SELENIOUS ACID"	"MONOHYDRATED SELENIUM DIOXIDE|SELENIOUS ACID|SELENIUM (AS SELENIOUS ACID)|SELENIUM DIOXIDE, MONOHYDRATED|UN 3283|UN-3283"	"Small molecule"	"4"	"128.97"	""	""	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"1"	"None"	"None"	"None"	"None"	"129.9169"	"None"	"H2O3Se"	"O=[Se](O)O"
"CHEMBL4297442"	"TD-139"	"GB-0139|GB0139|TD 139|TD-139|TD139"	"Small molecule"	"2"	"648.65"	"1"	"2"	"-0.12"	"201.26"	"15"	"6"	"3"	"8"	"N"	"0.15"	"12.52"	"0.05"	"1.05"	"1.05"	"4"	"MOL"	"0"	"45"	"14"	"6"	"3"	"648.1814"	"NEUTRAL"	"C28H30F2N6O8S"	"OC[C@H]1O[C@@H](S[C@@H]2O[C@H](CO)[C@H](O)[C@H](n3cc(-c4cccc(F)c4)nn3)[C@H]2O)[C@H](O)[C@@H](n2cc(-c3cccc(F)c3)nn2)[C@H]1O"
"CHEMBL2364655"	"EVOLOCUMAB"	"AMG-145|EVOLOCUMAB|REPATHA|REPATHA SURECLICK"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1201414"	"TINZAPARIN SODIUM"	"Innohep|LNH-1|LNH1|LOGIPARIN|TINZAPARIN|TINZAPARIN NA|TINZAPARIN SODIUM|TINZAPARIN SODIUM, PORCINE"	"Oligosaccharide"	"4"	""	"2"	"19"	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4802200"	"MUPADOLIMAB"	"CPI-006|CPX-006|MUPADOLIMAB"	"Antibody"	"1"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650407"	"MATRIX-M1 ADJUVANT"	"MATRIX-M|MATRIX-M1 ADJUVANT"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1535"	"HYDROXYCHLOROQUINE"	"HYDROXYCHLOROQUINE|Hydroxychloroquine|POLIRREUMIN"	"Small molecule"	"4"	"335.88"	"127"	"390"	"3.78"	"48.39"	"4"	"2"	"0"	"9"	"N"	"0.73"	"None"	"9.76"	"2.89"	"0.33"	"2"	"MOL"	"0"	"23"	"4"	"2"	"0"	"335.1764"	"BASE"	"C18H26ClN3O"	"CCN(CCO)CCCC(C)Nc1ccnc2cc(Cl)ccc12"
"CHEMBL550495"	"METHYLENE BLUE"	"BASIC BLUE 9 TRIHYDRATE|C.I. 52015|C.I. BASIC BLUE 9 TRIHYDRATE|CI 52015|CI-52015|METHYLENE BLUE|METHYLENE BLUE TRIHYDRATE|METHYLTHIONINE CHLORIDE|METHYLTHIONINE HYDROCHLORIDE|METHYLTHIONINIUM CHLORIDE|NSC-215213|NSC-617593|NSC-759135|PROVAYBLUE|TRX0014|UROLENE BLUE"	"Small molecule"	"4"	"373.91"	"38"	"88"	"2.50"	"19.14"	"3"	"0"	"0"	"1"	"Y"	"0.51"	"None"	"3.14"	"-0.62"	"-0.62"	"1"	"MOL"	"0"	"20"	"3"	"0"	"0"	"284.1216"	"NEUTRAL"	"C16H24ClN3O3S"	"CN(C)c1ccc2nc3ccc(=[N+](C)C)cc-3sc2c1.O.O.O.[Cl-]"
"CHEMBL2108340"	"TRIDECACTIDE"	".ALPHA.1-13-ACTH|ALPHA-1-13-CORTICOTROPIN, HUMAN|TRIDECACTIDE"	"Protein"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2095223"	"CHLOROQUINE SULPHATE"	"CHLOROQUINE SULFATE|CHLOROQUINE SULFATE MONOHYDRATE|CHLOROQUINE SULPHATE|CHLOROQUINI SULFAS|NSC-292296"	"Small molecule"	"4"	"417.96"	""	""	"4.81"	"28.16"	"3"	"1"	"0"	"8"	"N"	"0.76"	"None"	"10.32"	"3.93"	"0.88"	"2"	"MOL"	"0"	"22"	"3"	"1"	"0"	"319.1815"	"BASE"	"C18H28ClN3O4S"	"CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12.O=S(=O)(O)O"
"CHEMBL4298082"	"RECOMBINANT NEMATODE ANTICOAGULANT PROTEIN C2"	"RECOMBINANT NEMATODE ANTICOAGULANT PROTEIN C2|RECOMBINANT NEMATODE ANTICOAGULANT PROTEIN C2 (RNAPC2)|RNAPC2"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL930"	"GLUTAMINE"	"ENDARI|FEMA NO. 3684|GLUTAMINE|L-GLUTAMINE|LEVOGLUTAMIDE|NSC-27421|Nutrestore"	"Small molecule"	"4"	"146.15"	"26"	"63"	"-1.34"	"106.41"	"3"	"3"	"0"	"4"	"N"	"0.46"	"2.15"	"9.31"	"-4.00"	"-4.01"	"0"	"MOL"	"0"	"10"	"5"	"5"	"0"	"146.0691"	"ZWITTERION"	"C5H10N2O3"	"NC(=O)CC[C@H](N)C(=O)O"
"CHEMBL107"	"COLCHICINE"	"(-)-COLCHICINE|COLCHCINE|COLCHICINE|COLCHICINUM|COLCHINEOS|COLCHISOL|COLCRYS|Colchicine|GLOPERBA|MITIGARE|NSC-757"	"Small molecule"	"4"	"399.44"	"422"	"4584"	"2.87"	"83.09"	"6"	"1"	"0"	"5"	"N"	"0.83"	"None"	"None"	"1.46"	"1.46"	"2"	"MOL"	"0"	"29"	"7"	"1"	"0"	"399.1682"	"NEUTRAL"	"C22H25NO6"	"COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](NC(C)=O)CC2"
"CHEMBL1043"	"DAPSONE"	"ACZONE|DAPSONE|DAPSONUM|DIAMINODIPHENYLSULFONE|DIAPHENYLSULFONE|Diaphenylsulfone|J04BA02|NOVOPHONE|NSC-6091|NSC-6091D|SERVIDAPSON"	"Small molecule"	"4"	"248.31"	"71"	"229"	"1.68"	"86.18"	"4"	"2"	"0"	"2"	"N"	"0.79"	"None"	"2.39"	"1.27"	"1.27"	"2"	"MOL"	"0"	"17"	"4"	"4"	"0"	"248.0619"	"NEUTRAL"	"C12H12N2O2S"	"Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1"
"CHEMBL1163"	"ATAZANAVIR"	"ATAZANAVIR|Atazanavir|BMS-232632|CGP-73547|REYATAZ"	"Small molecule"	"4"	"704.87"	"44"	"794"	"4.21"	"171.22"	"9"	"5"	"1"	"14"	"N"	"0.15"	"11.92"	"4.42"	"4.54"	"4.54"	"3"	"MOL"	"0"	"51"	"13"	"5"	"2"	"704.3897"	"NEUTRAL"	"C38H52N6O7"	"COC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc1ccc(-c2ccccn2)cc1)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)C(C)(C)C"
"CHEMBL2108299"	"METFORMIN GLYCINATE"	"DMMET-01|METFORMIN GLYCINATE"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4802171"	"ENSOVIBEP"	"ENSOVIBEP|MP-0420|MP0420"	"Protein"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4298207"	"ZILUCOPLAN"	"RA101495|ZILUCOPLAN"	"Protein"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650486"	"ZANSECIMAB"	"LY-3127804|LY3127804|ZANSECIMAB"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650429"	"TOZINAMERAN"	"BNT-162B2|BNT162B2|COMIRNATY|PFIZER COVID-19 VACCINE|RNA INGREDIENT BNT-162B2|TOZINAMERAN"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1201460"	"DALTEPARIN SODIUM"	".ALPHA.-HEPARIN|B01AB04|BOXOL|DALTEPARIN|DALTEPARIN SODIUM|FR-860|FRAGMINE|Fragmin|HEPARIN FRAGMENT KABI 2165|KABI-2165|LOW LIQUEMINE|LOW-LIQUEMINE"	"Oligosaccharide"	"4"	""	"4"	"24"	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL635"	"PREDNISONE"	"3EN3HG4WSW|CORTAN|CORTANCYL|DECORTIN|DECORTISYL|DEHYDROCORTISONE|Delta-dome|Deltasone|FERNISONE|LIQUID PRED|LODOTRA|METACORTANDRACIN|Meticorten|NSC-10023|Orasone|PARACORT|PREDNICEN-M|PREDNISONE|PREDNISONE ANHYDROUS|PREDNISONE INTENSOL|PREDNISONE TABLETS|Prednisone|RAYOS|SERVISONE|SUPERCORTIL|Sterapred"	"Small molecule"	"4"	"358.43"	"212"	"855"	"1.77"	"91.67"	"5"	"2"	"0"	"2"	"N"	"0.78"	"12.58"	"None"	"1.66"	"1.66"	"0"	"MOL"	"0"	"26"	"5"	"2"	"0"	"358.1780"	"NEUTRAL"	"C21H26O5"	"C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO"
"CHEMBL4594542"	"EFLEPEDOCOKIN ALFA"	"EFLEPEDOCOKIN ALFA|F-652|IL-22 DIMER F-652|PROMENAKIN"	"Protein"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4802199"	"BBV-152 ANTIGEN ADJUVATED WITH ALGEL-IMDG"	"BBV-152 ANTIGEN ADJUVATED WITH ALGEL-IMDG|COVAXIN"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1201187"	"MARAVIROC"	"CELSENTRI|MARAVIROC|Maraviroc|Rel-Maraviroc|SELZENTRY|UK-427857"	"Small molecule"	"4"	"513.68"	"38"	"193"	"5.95"	"63.05"	"5"	"1"	"2"	"8"	"N"	"0.47"	"13.98"	"9.35"	"3.63"	"1.68"	"2"	"MOL"	"0"	"37"	"6"	"1"	"2"	"513.3279"	"BASE"	"C29H41F2N5O"	"Cc1nnc(C(C)C)n1[C@H]1C[C@@H]2CC[C@H](C1)N2CC[C@H](NC(=O)C1CCC(F)(F)CC1)c1ccccc1"
"CHEMBL2106041"	"AVIPTADIL"	"AVIPTADIL|SAMIVIRTM|SamiAIRTM|SamiVIPTM|VIP HUMAN VIP|ZYESAMI"	"Protein"	"3"	"3255.75"	""	""	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"BOTH"	"0"	"None"	"None"	"None"	"None"	"3253.6918"	"None"	"C145H232N40O43S"	"CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(C)C)[C@@H](C)O)[C@H](O)CC)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)O"
"CHEMBL4650385"	"CARRIMYCIN"	"4''-ISOVALERYLSPIRAMYCIN|CARRIMYCIN"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2219413"	"BRILACIDIN"	"BRILACIDIN|PMX-30063 FREE BASE|PMX30063|PMX30063 FREE BASE"	"Small molecule"	"2"	"936.92"	"4"	"33"	"3.68"	"308.50"	"12"	"12"	"3"	"20"	"N"	"0.03"	"11.91"	"12.25"	"0.69"	"-8.70"	"3"	"MOL"	"0"	"66"	"20"	"14"	"3"	"936.3942"	"BASE"	"C40H50F6N14O6"	"N=C(N)NCCCCC(=O)Nc1cc(C(F)(F)F)cc(NC(=O)c2cc(C(=O)Nc3cc(C(F)(F)F)cc(NC(=O)CCCCNC(=N)N)c3O[C@@H]3CCNC3)ncn2)c1O[C@@H]1CCNC1"
"CHEMBL1201724"	"POVIDONE-IODINE"	"BETADINE VC KIT|BETASEPT|Betadine|CODELLA|E-Z PREP|E-Z PREP 220|E-Z SCRUB 201|E-Z SCRUB 241|E-z Scrub|NSC-26245|POVIDONE IODINE|POVIDONE-IODINE|PVP-IODINE"	"Unknown"	"4"	""	"2"	"19"	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1569"	"AMANTADINE HYDROCHLORIDE"	"ADAMANTANAMINE HYDROCHLORIDE|AMANTADINE HCL|AMANTADINE HYDROCHLORIDE|EXP-105-1|GOCOVRI|LYSOVIR|MANTADINE|MANTADIX|NSC-83653|OSMOLEX|OSMOLEX ER|Symadine|Symmetrel"	"Small molecule"	"4"	"187.71"	"41"	"69"	"1.91"	"26.02"	"1"	"1"	"0"	"0"	"Y"	"0.56"	"None"	"10.71"	"1.47"	"-1.38"	"0"	"MOL"	"0"	"11"	"1"	"2"	"0"	"151.1361"	"BASE"	"C10H18ClN"	"Cl.NC12CC3CC(CC(C3)C1)C2"
"CHEMBL556"	"DEFEROXAMINE"	"DEFEROXAMINE|DESFEROXAMINE B|DESFERRIOXAMINE|DESFERRIOXAMINE B|DFO-B|Deferoxamine|Desferal|NSC-527604"	"Small molecule"	"4"	"560.69"	"70"	"341"	"0.92"	"205.84"	"9"	"6"	"2"	"23"	"N"	"0.06"	"7.92"	"10.21"	"-3.37"	"-3.64"	"0"	"MOL"	"0"	"39"	"14"	"7"	"3"	"560.3534"	"BASE"	"C25H48N6O8"	"CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN"
"CHEMBL628"	"PENTOXIFYLLINE"	"BL 191|BL-191|C04AD03|NEOTREN MR|NSC-637086|NSC-758481|OXPENTIFYLLINE|OXYPENTIFYLLINE|PENTOXIFYLLINE|PENTOXIPHYLLIN|Pentoxil|TRENTAL 100|TRENTAL 400|Trental"	"Small molecule"	"4"	"278.31"	"163"	"811"	"0.19"	"78.89"	"7"	"0"	"0"	"5"	"N"	"0.73"	"None"	"None"	"0.23"	"0.23"	"2"	"MOL"	"0"	"20"	"7"	"0"	"0"	"278.1379"	"NEUTRAL"	"C13H18N4O3"	"CC(=O)CCCCn1c(=O)c2c(ncn2C)n(C)c1=O"
"CHEMBL451930"	"PLITIDEPSIN"	"APLIDIN|APLIDINE|PLITIDEPSIN"	"Small molecule"	"3"	"1110.36"	"1"	"2"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"0"	"None"	"None"	"None"	"None"	"1109.6260"	"None"	"C57H87N7O15"	"CC[C@H](C)[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)C(C)=O)[C@@H](C)OC(=O)[C@H](Cc2ccc(OC)cc2)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)C(=O)[C@H](C(C)C)OC(=O)C[C@@H]1O"
"CHEMBL1229"	"OSELTAMIVIR"	"GS 4104|GS-4071 ETHYL ESTER|GS-4104|GS4104|OSELTAMIVIR|Oseltamivir Carboxylate|RO 640796|RO-64-0796|RO-640796|RO64-0796"	"Small molecule"	"4"	"312.41"	"70"	"1160"	"1.29"	"90.65"	"5"	"2"	"0"	"7"	"N"	"0.69"	"None"	"9.31"	"1.16"	"-0.72"	"0"	"MOL"	"0"	"22"	"6"	"3"	"0"	"312.2049"	"BASE"	"C16H28N2O4"	"CCOC(=O)C1=C[C@@H](OC(CC)CC)[C@H](NC(C)=O)[C@@H](N)C1"
"CHEMBL1064"	"SIMVASTATIN"	"C10AA01|FLOLIPID|LACERSA|MK-0733|MK-733|NSC-758706|RANZOLONT|SIMVADOR|SIMVASTATIN|SYNVINOLIN|Simvastatin hydroxy acid|ZOCOR HEART-PRO|Zocor"	"Small molecule"	"4"	"418.57"	"226"	"2829"	"4.59"	"72.83"	"5"	"1"	"0"	"6"	"N"	"0.64"	"None"	"None"	"4.46"	"4.46"	"0"	"MOL"	"0"	"30"	"5"	"1"	"0"	"418.2719"	"NEUTRAL"	"C25H38O5"	"CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]21"
"CHEMBL4802191"	"BEMNIFOSBUVIR HEMISULFATE"	"AT-527|BEMNIFOSBUVIR HEMISULFATE"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4297725"	"CHLORINE DIOXIDE"	"CHLORINE DIOXIDE|CHLORINE PEROXIDE"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2108813"	"WAX, EMULSIFYING"	"BUFF|COCONUT OIL|COCONUT OIL, UNHYDROGENATED|EMULFIN|EMULSIF|EMULSIFYING WAX|EPADERM|H.E.B.|LANETTE WAX|LANETTE WAX SX|OIL, COCONUT|OIL,COCNT|WAX, EMULSIFYING"	"Unknown"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL986"	"RETINOL"	"AROVIT|Aquasol A|NEPALM|NSC-122759|OLEOVITAMIN A|RETINOL|RETINOL (VIT A)|RETINOL ACETATE|RETINOL PALMITATE|RO-A-VIT|Retinol|VITAMIN A|VITAMIN A OIL|Vitamin A|Vitamin A 1|Vitamin a solubilized"	"Small molecule"	"4"	"286.46"	"111"	"1636"	"5.51"	"20.23"	"1"	"1"	"1"	"5"	"N"	"0.66"	"None"	"None"	"4.69"	"4.69"	"0"	"MOL"	"0"	"21"	"1"	"1"	"1"	"286.2297"	"NEUTRAL"	"C20H30O"	"CC1=C(/C=C/C(C)=C/C=C/C(C)=C/CO)C(C)(C)CCC1"
"CHEMBL4650382"	"BRII-196"	"AMUBARVIMAB|BRII-196"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650410"	"NOVAFERON"	"NOVA (ARTIFICIAL INTERFERON)|NOVAFERON|RECOMBINANT INTERFERON ALPHA 2B-LIKE PROTEIN"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1651956"	"ALISPORIVIR"	"(D-MEALA)3-(ETVAL)4-CSA|ALISPORIVIR|DEB 025|DEB-025|DEB025|DEBIO 025|DEBIO-025|Debio 025|UNIL 025|UNIL-025"	"Protein"	"3"	"1216.66"	"49"	"154"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"BOTH"	"0"	"None"	"None"	"None"	"None"	"1215.8570"	"None"	"C63H113N11O12"	"C/C=C/C[C@@H](C)[C@@H](O)[C@H]1C(=O)N[C@@H](CC)C(=O)N(C)[C@H](C)C(=O)N(CC)[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1C"
"CHEMBL1201593"	"ALTEPLASE"	"ACTILYSE|ACTILYSE CATHFLO|ALTEPLASE|ALTEPLASE (GENETICAL RECOMBINATION)|ALTEPLASE FOR INJECTION|ALTEPLASE, RECOMBINANT|ALTEPLASE,RECOMBINANT|Activase|CATHFLO ACTIVASE|EC 3.4.21.68|RT-PA|TISSUE PLASMINOGEN ACTIVATOR ALTEPLASE"	"Enzyme"	"4"	""	"2"	"19"	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL458875"	"CLEVUDINE"	"CLEVUDINE|L-FMAU|LEVOVIR"	"Small molecule"	"3"	"260.22"	"7"	"32"	"-1.57"	"104.55"	"6"	"3"	"0"	"2"	"N"	"0.60"	"10.10"	"None"	"-1.13"	"-1.13"	"1"	"MOL"	"0"	"18"	"7"	"3"	"0"	"260.0808"	"NEUTRAL"	"C10H13FN2O5"	"Cc1cn([C@H]2O[C@@H](CO)[C@H](O)[C@H]2F)c(=O)[nH]c1=O"
"CHEMBL416956"	"MEFLOQUINE"	"GNF-Pf-5544|Lariam|MEFLOQUINE|Mefaquin|Mefloquine|NSC-758233|RO 21-5998|RO-215998|WR 142,490"	"Small molecule"	"4"	"378.32"	"72"	"719"	"4.45"	"45.15"	"3"	"2"	"0"	"2"	"N"	"0.76"	"13.79"	"9.46"	"4.11"	"2.07"	"2"	"MOL"	"0"	"26"	"3"	"2"	"0"	"378.1167"	"BASE"	"C17H16F6N2O"	"OC(c1cc(C(F)(F)F)nc2c(C(F)(F)F)cccc12)C1CCCCN1"
"CHEMBL1098659"	"WATER"	"ADELHEID AQUA|ADELHEIDSQUELLE|AQUA ADELHEID|AQUA PRO INJECTIONE|AQUA PURIFICATA|AQUA STERILISATA PRO INJECTIONE|AQUA WIESBADEN|AQUA WILDBAD|B1217|NSC-147337|PUR-WASH|PURIFIED WATER|R-718|STERILE PURIFIED WATER|STERILE WATER|STERILE WATER FOR INHALATION|STERILE WATER FOR INJECTION|STERILE WATER FOR INJECTIONS|STERILE WATER FOR IRRIGATION|ULTREX II ULTRAPURE|WATER|WATER FOR HEMODIALYSIS|WATER FOR INHALATION, STERILE|WATER FOR INJECTION|WATER FOR INJECTIONS|WATER FOR IRRIGATION,STERILE|WATER PURIFIED|WATER, DEIONIZED|WATER, PURIFIED|WATER, PURIFIED STERILE|WATER, STERILE PURIFIED|WATER,BACTERIOSTATIC|WATER,BACTERIOSTATIC INJECTION|WATER,DEIONIZED|WATER,DISTILLED|WATER,PURIFIED|WATER,SANITIZED|WATER,STERILE|WIESBADEN|WIESBADEN AQUA|WILDBAD AQUA"	"Small molecule"	"4"	"18.02"	"3"	"3"	"-0.82"	"31.50"	"0"	"0"	"0"	"0"	"Y"	"0.33"	"None"	"None"	"-0.65"	"-0.65"	"0"	"MOL"	"0"	"1"	"1"	"2"	"0"	"18.0106"	"NEUTRAL"	"H2O"	"O"
"CHEMBL4650454"	"ABDAVOMERAN"	"ABDAVOMERAN|BNT-162B1|BNT162B1"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4594473"	"ESCIN"	"AESCIN|ESCIN"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1256"	"ISOFLURANE"	"AERRANE|COMPOUND 469|COMPOUND-469|Forane|ISOFLURANE"	"Small molecule"	"4"	"184.49"	"9"	"64"	"2.35"	"9.23"	"1"	"0"	"0"	"2"	"Y"	"0.47"	"None"	"None"	"2.84"	"2.84"	"0"	"MOL"	"0"	"10"	"1"	"0"	"0"	"183.9714"	"NEUTRAL"	"C3H2ClF5O"	"FC(F)OC(Cl)C(F)(F)F"
"CHEMBL2035187"	"PACRITINIB"	"ONX-0803|PACRITINIB|Pacritinib|SB-1518|SB1518"	"Small molecule"	"3"	"472.59"	"300"	"384"	"4.96"	"68.74"	"7"	"1"	"0"	"4"	"N"	"0.54"	"None"	"8.86"	"4.58"	"3.11"	"3"	"MOL"	"0"	"35"	"7"	"1"	"0"	"472.2474"	"BASE"	"C28H32N4O3"	"C1=C/COCc2cc(ccc2OCCN2CCCC2)Nc2nccc(n2)-c2cccc(c2)COC/1"
"CHEMBL633"	"AMIODARONE"	"AMIODARONE|Amiodarone|Cordarone|L-3428|Pacerone|SKF 33134-A"	"Small molecule"	"4"	"645.32"	"218"	"2457"	"6.94"	"42.68"	"4"	"0"	"2"	"11"	"N"	"0.17"	"None"	"8.47"	"7.64"	"6.53"	"3"	"MOL"	"0"	"31"	"4"	"0"	"2"	"645.0237"	"NEUTRAL"	"C25H29I2NO3"	"CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCN(CC)CC)c(I)c1"
"CHEMBL2028852"	"ICATIBANT ACETATE"	"FIRAZYR|HOE 140|HOE-140|ICATIBANT ACETATE"	"Protein"	"4"	"1364.60"	""	""	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"BOTH"	"0"	"None"	"None"	"None"	"None"	"1303.6608"	"None"	"C61H93N19O15S"	"CC(=O)O.N=C(N)NCCC[C@H](NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)[C@H]1Cc2ccccc2CN1C(=O)[C@H](CO)NC(=O)[C@H](Cc1cccs1)NC(=O)CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](N)CCCNC(=N)N)C(=O)O"
"CHEMBL2105759"	"BARICITINIB"	"BARICITINIB|BARICITINIB PHOSPHATE|BARICITINIB PHOSPHATE SALT|Baricitinib|INCB-028050|INCB-28050|INCB028050|LY-3009104|LY3009104|OLUMIANT"	"Small molecule"	"4"	"371.43"	"304"	"374"	"1.10"	"120.56"	"7"	"1"	"0"	"5"	"N"	"0.72"	"13.89"	"3.91"	"-0.19"	"-0.19"	"3"	"MOL"	"0"	"26"	"9"	"1"	"0"	"371.1164"	"NEUTRAL"	"C16H17N7O2S"	"CCS(=O)(=O)N1CC(CC#N)(n2cc(-c3ncnc4[nH]ccc34)cn2)C1"
"CHEMBL2108806"	"BEMIPARIN SODIUM"	"BADYKET|BEMIPARIN SODIUM|HIBOR|ZIBOR|ZIVOR"	"Oligosaccharide"	"4"	""	"2"	"19"	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL51085"	"EBSELEN"	"DR-3305|DR3305|EBSELEN|NSC-639762|NSC-757883|SPI-1005"	"Small molecule"	"3"	"274.18"	"207"	"790"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"0"	"None"	"None"	"None"	"None"	"274.9849"	"None"	"C13H9NOSe"	"O=c1c2ccccc2[se]n1-c1ccccc1"
"CHEMBL786"	"TAMOXIFEN CITRATE"	"EMBLON|FENTAMOX 10|FENTAMOX 20|I.C.I.46474 CITRATE|ICI 46,474|ICI-46474|KENTADEX|KESSAR|KESSAR 10|KESSAR 20|Kessar|NOLTAM|NOLVADEX D|NOLVADEX FTE|NOURYTAM|NSC-180973|NSC-757345|Nolvadex|OESTRIFEN-10|OESTRIFEN-20|OESTRIFEN-40|Soltamox|TAMOFEN|TAMOFENE|TAMOXIFEN CITRATE|TAMOXIFENI CITRAS|TOMAXASTA|ZEMIDE|ZITAZONIUM|Zynoplex"	"Small molecule"	"4"	"563.65"	"149"	"390"	"6.00"	"12.47"	"2"	"0"	"1"	"8"	"N"	"0.45"	"None"	"8.76"	"6.35"	"4.97"	"3"	"MOL"	"0"	"28"	"2"	"0"	"1"	"371.2249"	"BASE"	"C32H37NO8"	"CC/C(=C(\c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1.O=C(O)CC(O)(CC(=O)O)C(=O)O"
"CHEMBL4297455"	"AT-001"	"ALDOSE REDUCTASE-IN-1|AT-001|CAFICRESTAT"	"Small molecule"	"3"	"421.36"	""	""	"2.49"	"110.86"	"8"	"1"	"0"	"4"	"N"	"0.54"	"3.58"	"2.27"	"1.89"	"-1.26"	"4"	"MOL"	"0"	"29"	"8"	"1"	"0"	"421.0456"	"ACID"	"C17H10F3N5O3S"	"O=C(O)Cc1nn(Cc2nc3cc(C(F)(F)F)ccc3s2)c(=O)c2nccnc12"
"CHEMBL4802204"	"ZORECIMERAN"	"CV-07050101|CV07050101|CVNCOV|ZORECIMERAN"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650378"	"AZOXIMER BROMIDE"	"AZOXIMER BROMIDE"	"Small molecule"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1471"	"APREPITANT"	"APREPITANT|CINVANTI|Emend|L-754,030|MK-0869|MK-869|NSC-748825"	"Small molecule"	"4"	"534.43"	"27"	"147"	"4.95"	"83.24"	"5"	"2"	"1"	"6"	"N"	"0.44"	"6.59"	"3.63"	"5.22"	"4.51"	"3"	"MOL"	"0"	"37"	"7"	"2"	"1"	"534.1502"	"NEUTRAL"	"C23H21F7N4O3"	"C[C@@H](O[C@H]1OCCN(Cc2n[nH]c(=O)[nH]2)[C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1"
"CHEMBL148674"	"VARESPLADIB"	"LY-315920|LY315920|VAREPLADIB|VARESPLADIB|VARESPLADIB SODIUM"	"Small molecule"	"2"	"380.40"	"25"	"90"	"2.38"	"111.62"	"5"	"2"	"0"	"8"	"N"	"0.46"	"3.62"	"None"	"2.77"	"-0.56"	"3"	"MOL"	"0"	"28"	"7"	"3"	"0"	"380.1372"	"ACID"	"C21H20N2O5"	"CCc1c(C(=O)C(N)=O)c2c(OCC(=O)O)cccc2n1Cc1ccccc1"
"CHEMBL1200689"	"NITRIC OXIDE"	"AMIDOGEN, OXO-|GENOSYL|INOVENT|Inomax|NITRIC OXIDE|NITRIC OXIDE TRIMER|NITROGEN OXIDE (NO)|NITROSYL RADICAL|Nitric oxide|OHM-11771"	"Small molecule"	"4"	"30.01"	"3"	"16"	"-0.45"	"39.37"	"1"	"0"	"0"	"0"	"Y"	"0.36"	"None"	"None"	"-0.35"	"-0.35"	"0"	"MOL"	"0"	"2"	"2"	"0"	"0"	"29.9980"	"NEUTRAL"	"NO"	"[N]=O"
"CHEMBL284906"	"NICORANDIL"	"IKOREL|NICORANDIL|SG-75|SIGMART"	"Small molecule"	"4"	"211.18"	"39"	"74"	"0.02"	"94.36"	"5"	"1"	"0"	"5"	"N"	"0.42"	"13.81"	"3.62"	"-0.16"	"-0.16"	"1"	"MOL"	"0"	"15"	"7"	"1"	"0"	"211.0593"	"NEUTRAL"	"C8H9N3O4"	"O=C(NCCO[N+](=O)[O-])c1cccnc1"
"CHEMBL3219124"	"AZD-1656"	"AZD 1656|AZD-1656|AZD1656"	"Small molecule"	"2"	"478.51"	"8"	"23"	"2.88"	"128.66"	"9"	"1"	"0"	"9"	"N"	"0.49"	"13.09"	"1.58"	"0.80"	"0.80"	"3"	"MOL"	"0"	"35"	"11"	"1"	"1"	"478.1965"	"NEUTRAL"	"C24H26N6O5"	"COC[C@H](C)Oc1cc(Oc2cnc(C(=O)N3CCC3)cn2)cc(C(=O)Nc2cnc(C)cn2)c1"
"CHEMBL590799"	"CAMOSTAT"	"CAMOSTAT"	"Small molecule"	"3"	"398.42"	"22"	"43"	"1.39"	"134.81"	"6"	"3"	"0"	"7"	"N"	"0.28"	"None"	"8.54"	"1.51"	"0.36"	"2"	"MOL"	"0"	"29"	"9"	"4"	"0"	"398.1590"	"BASE"	"C20H22N4O5"	"CN(C)C(=O)COC(=O)Cc1ccc(OC(=O)c2ccc(NC(=N)N)cc2)cc1"
"CHEMBL1201589"	"OMALIZUMAB"	"CT-P39|HS632|IGE25|OLIZUMAB|OMALIZUMAB|RG-3648|RHUMAB-E25|Xolair"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL3544984"	"TRADIPITANT"	"LY-686017|LY686017|TRADIPITANT|Tradipitant|VLY-686"	"Small molecule"	"3"	"587.91"	""	""	"7.37"	"73.56"	"6"	"0"	"2"	"6"	"N"	"0.15"	"None"	"4.17"	"7.11"	"7.11"	"5"	"MOL"	"0"	"41"	"6"	"0"	"2"	"587.0948"	"NEUTRAL"	"C28H16ClF6N5O"	"O=C(c1ccccc1Cl)c1cccnc1-c1nnn(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1-c1ccncc1"
"CHEMBL1879463"	"DACTOLISIB"	"BEZ-235|BEZ235|DACTOLISIB|Dactolisib|NSC-751249|NVP-BEZ-235|NVP-BEZ235|NVP-BEZ235-NX|RTB-101|RTB101"	"Small molecule"	"3"	"469.55"	"907"	"1280"	"5.89"	"76.50"	"6"	"0"	"1"	"3"	"N"	"0.32"	"None"	"4.07"	"5.65"	"5.65"	"6"	"MOL"	"0"	"36"	"6"	"0"	"1"	"469.1903"	"NEUTRAL"	"C30H23N5O"	"Cn1c(=O)n(-c2ccc(C(C)(C)C#N)cc2)c2c3cc(-c4cnc5ccccc5c4)ccc3ncc21"
"CHEMBL2107825"	"TENOFOVIR ALAFENAMIDE"	"GS-7340|GS-734003|TENOFOVIR ALAFENAMIDE|VEMLIDY"	"Small molecule"	"4"	"476.47"	"13"	"55"	"2.97"	"143.48"	"10"	"2"	"0"	"11"	"N"	"0.31"	"11.36"	"3.74"	"1.88"	"1.88"	"3"	"MOL"	"0"	"33"	"11"	"3"	"1"	"476.1937"	"NEUTRAL"	"C21H29N6O5P"	"CC(C)OC(=O)[C@H](C)N[P@](=O)(CO[C@H](C)Cn1cnc2c(N)ncnc21)Oc1ccccc1"
"CHEMBL2103979"	"THYMALFASIN"	"THYMALFASIN|THYMOSIN ALPHA1|THYMOSINS THYMALFASIN|Zadaxin"	"Protein"	"3"	"3108.31"	""	""	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"BOTH"	"0"	"None"	"None"	"None"	"None"	"3106.5041"	"None"	"C129H215N33O55"	"CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(C)=O)C(C)C)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O"
"CHEMBL4650314"	"DESIDUSTAT"	"DESIDUSTAT|ZYAN-1|ZYAN1"	"Small molecule"	"3"	"332.31"	""	""	"0.36"	"117.86"	"6"	"3"	"0"	"6"	"N"	"0.70"	"3.17"	"None"	"0.12"	"-5.44"	"2"	"MOL"	"0"	"24"	"8"	"3"	"0"	"332.1008"	"ACID"	"C16H16N2O6"	"O=C(O)CNC(=O)c1c(O)c2ccccc2n(OCC2CC2)c1=O"
"CHEMBL4650383"	"BRII-198"	"BRII-198|ROMLUSEVIMAB"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1201583"	"BEVACIZUMAB"	"12-IGG1|ABP-215|AVA-1|AVASTIN|BEVACIZUMAB|BEVACIZUMAB BETA|BEVACIZUMAB BIOSIMILAR (FKB-238)|BEVACIZUMAB-AWWB|BEVACIZUMAB-BVZR|BI 695502|BI-695502|BS-503|BS-503A|BYVASDA|CHS-5217|CT-16|CT-P16|CT-P16 (BIOSIMILAR OF BEVACIZUMAB)|FKB-238|FKB238|HLX-04|HLX04|IBI-305|IBI305|MVASI|PF-06439535|R-435|RG-435|RHUMAB-|RHUMAB-VEGF|USP MAB 002, MONOCLONAL IGG1|ZIRABEV"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1536"	"ERGOCALCIFEROL"	"CALCIFEROL|CALCIFEROL IN ARACH OIL|CALTRATE|Calciferol|D-FORTE|Deltalin|Drisdol|ECIFEROL D2|ERGO-D2|ERGOCALCIFEROL|ERGOCALCIFEROLUM|ERGORAL D2|ERGORONE|Ergocalciferol|LANES|NSC-62792|OLEOVITAMIN D, SYNTHETIC|OSTELIN|OSTO-D2|Oleovitamin D|STEROGYL|STEROGYL 15H|STEROGYL-15|UVESTEROL D|VIOSTEROL|VIOSTEROL IN OIL|VITAMIN D|VITAMIN D (ERGOCALCIFEROL)|VITAMIN D2|Vitamin D 2"	"Small molecule"	"4"	"396.66"	"140"	"514"	"7.64"	"20.23"	"1"	"1"	"1"	"5"	"N"	"0.47"	"None"	"None"	"7.05"	"7.05"	"0"	"MOL"	"0"	"29"	"1"	"1"	"1"	"396.3392"	"NEUTRAL"	"C28H44O"	"C=C1CC[C@H](O)C/C1=C/C=C1\CCC[C@@]2(C)[C@H]1CC[C@@H]2[C@H](C)/C=C/[C@H](C)C(C)C"
"CHEMBL250450"	"ISOQUERCETIN"	"3-GLUCOSYLQUERCETIN|CONTIGOSIDE B|FEMA NO. 4225|GLUCOSYL-3-QUERCETIN|HIRSUTRIN|ISOQUERCETIN|ISOQUERCETIN, (-)-|ISOQUERCITRIN|ISOQUERCITROSIDE|ISOTRIFOLIIN|ISOTRIFOLIN|NSC-115918|NSC-407304|QUERCETIN 3-D-GLUCOSIDE|QUERCETIN 3-O-GLUCOPYRANOSIDE|QUERCETIN 3-O-GLUCOSIDE|QUERCETIN 3.BETA.-GLUCOSIDE|QUERCETIN GLUCOSIDE|QUERCETIN-3-GLUCOSE|QUERCETIN-3-O-GLUCOSIDE|QUERCETOL 3-MONOGLUCOSIDE|RONACARE ISOQUERCETIN"	"Small molecule"	"2"	"464.38"	"119"	"368"	"-0.54"	"210.51"	"12"	"8"	"2"	"4"	"N"	"0.23"	"6.37"	"None"	"-0.14"	"-1.30"	"3"	"MOL"	"0"	"33"	"12"	"8"	"2"	"464.0955"	"ACID"	"C21H20O12"	"O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12"
"CHEMBL1741"	"CLARITHROMYCIN"	"6-O-METHYLERYTHROMYCIN|A-56268|ABBOTT-56268|BIAXIN XL|Biaxin|Biaxin XL Pac|CLARIE XL|CLARITHROMYCIN|CLARITHROMYCIN IDENTITY|CLAROSIP|CYLLIND|Clarithromycin extended release|ERYTHROMYCIN, 6-O-METHYL-|FEBZIN XL|KLACID|KLARICID|KLARICID 500|KLARICID ADULT|KLARICID I.V.|KLARICID PAED|KLARICID XL|MACLADIN|MAVID|MYCIFOR XL|NSC-758704|Prevpac|TE-031|VECLAM|XETININ XL|ZECLAR"	"Small molecule"	"4"	"747.96"	"223"	"3120"	"2.44"	"182.91"	"14"	"4"	"2"	"8"	"N"	"0.27"	"12.46"	"8.38"	"3.24"	"2.22"	"0"	"MOL"	"0"	"52"	"14"	"4"	"2"	"747.4769"	"NEUTRAL"	"C38H69NO13"	"CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O"
"CHEMBL3235620"	"ANTROQUINONOL"	"ANTROQUINONOL A|Antroquinonol|HOCENA|J3.387.174K"	"Small molecule"	"2"	"390.56"	"4"	"8"	"5.50"	"55.76"	"4"	"1"	"1"	"10"	"N"	"0.50"	"13.51"	"None"	"4.73"	"4.73"	"0"	"MOL"	"0"	"28"	"4"	"1"	"1"	"390.2770"	"NEUTRAL"	"C24H38O4"	"COC1=C(OC)[C@H](O)[C@H](C/C=C(\C)CC/C=C(\C)CCC=C(C)C)[C@@H](C)C1=O"
"CHEMBL38"	"TRETINOIN"	"ABEREL|ACTICIN|ALL-TRANS RETINOIC ACID|ALL-TRANS-RETINOIC ACID|ALTRENO|ATRALIN|Avita|EUDYNA|KERLOCAL|NSC-122758|ORISTAR RNA|RETIN A|RETIN-A MICRO|RETIN-A-MICRO|RETINOIC ACID|Renova|Retin-A|TRETINOIN|Tretin-X|Vesanoid"	"Small molecule"	"4"	"300.44"	"832"	"2215"	"5.60"	"37.30"	"1"	"1"	"1"	"5"	"N"	"0.53"	"4.76"	"None"	"5.01"	"2.42"	"0"	"MOL"	"0"	"22"	"2"	"1"	"1"	"300.2089"	"ACID"	"C20H28O2"	"CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)O)C(C)(C)CCC1"
"CHEMBL2107951"	"MALTODEXTRIN"	"DEXTRI-MALTOSE|FORTICAL|GLUCIDEX|GLUCODRY|LEPPIN|MALDEX|MALDRIN|MALTODEXTRIN|POLYCAL|STAR-DRI"	"Unknown"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL409"	"BICALUTAMIDE"	"BICALUTAMIDE|Calutide|Casodex|Cosudex|ICI 176,334|ICI-176334|ICI176,334-1|Kalumid|NSC-759816"	"Small molecule"	"4"	"430.38"	"720"	"1093"	"2.88"	"107.26"	"5"	"2"	"0"	"5"	"N"	"0.56"	"11.78"	"None"	"2.71"	"2.71"	"2"	"MOL"	"0"	"29"	"6"	"2"	"0"	"430.0610"	"NEUTRAL"	"C18H14F4N2O4S"	"CC(O)(CS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1"
"CHEMBL1431"	"METFORMIN"	"LA-6023|METFORMIN|METFORMIN EXTENDED RELEASE|Metformin"	"Small molecule"	"4"	"129.17"	"727"	"2787"	"-1.03"	"88.99"	"2"	"4"	"0"	"0"	"N"	"0.25"	"None"	"12.33"	"-0.92"	"-5.62"	"0"	"MOL"	"0"	"9"	"5"	"5"	"0"	"129.1014"	"BASE"	"C4H11N5"	"CN(C)C(=N)NC(=N)N"
"CHEMBL64391"	"ITRACONAZOLE"	"CANDISTAT|CANDITRAL|CLADOSAL 100|FUNGITRAXX|ITRAC|ITRACONAZOLE|ITRALEK|ITRAZOLE|ITRIZOLE|NSC-759239|ONMEL|ORUNGAL|R 51,211|R-51211|SEMPERA|SPHERAZOLE CR|SPHERAZOLE IR|SPORAMELT|SPORANOX I.V.|SPORANOX-PULSE|SPORONOX|Sporanos|Sporanox|TOLSURA|TRACONAL|TRIASPORIN"	"Small molecule"	"4"	"705.65"	"308"	"3282"	"5.58"	"104.70"	"12"	"0"	"3"	"11"	"N"	"0.17"	"None"	"3.91"	"7.31"	"7.31"	"5"	"MOL"	"0"	"49"	"12"	"0"	"3"	"704.2393"	"NEUTRAL"	"C35H38Cl2N8O4"	"CCC(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(Cl)cc6Cl)O5)cc4)CC3)cc2)c1=O"
"CHEMBL3137335"	"TRANSCROCETINATE SODIUM"	"DISODIUM TRANS-CROCETINATE|TRANS SODIUM CROCETINATE|TRANSCROCETINATE SODIUM|TSC"	"Small molecule"	"3"	"372.37"	""	""	"4.61"	"74.60"	"2"	"2"	"0"	"8"	"N"	"0.50"	"4.41"	"None"	"4.40"	"-0.87"	"0"	"MOL"	"0"	"24"	"4"	"2"	"0"	"328.1675"	"ACID"	"C20H22Na2O4"	"CC(/C=C/C=C(\C)C(=O)[O-])=C\C=C\C=C(C)\C=C\C=C(/C)C(=O)[O-].[Na+].[Na+]"
"CHEMBL1017"	"TELMISARTAN"	"BIBR 277 SE|BIBR-277|BIBR-277 SE|BIBR-277-SE|BIBR-277SE|C09CA07|KINZALMONO|Micardis|PRITOR|SEMINTRA|TELMISARTAN|TELMISARTAN ACTAVIS|TELMISARTAN TEVA|TOLURA"	"Small molecule"	"4"	"514.63"	"93"	"460"	"7.26"	"72.94"	"5"	"1"	"2"	"7"	"N"	"0.24"	"3.62"	"5.86"	"6.13"	"4.86"	"6"	"MOL"	"0"	"39"	"6"	"1"	"2"	"514.2369"	"ACID"	"C33H30N4O2"	"CCCc1nc2c(C)cc(-c3nc4ccccc4n3C)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1"
"CHEMBL1201558"	"INTERFERON ALFA-2B"	"INTERFERON ALFA-2B|Intron A|Intron A HSA-free|Intron-A|SCH 30500|SCH-30500|Viraferon"	"Protein"	"4"	""	"2"	"19"	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2109377"	"PAMREVLUMAB"	"FG-3019|PAMREVLUMAB"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1256391"	"PIRFENIDONE"	"AMR-69|ESBRIET|NSC-748456|PIRESPA|PIRFENIDONE"	"Small molecule"	"4"	"185.23"	"40"	"127"	"2.15"	"22.00"	"2"	"0"	"0"	"1"	"Y"	"0.67"	"None"	"None"	"2.14"	"2.14"	"2"	"MOL"	"0"	"14"	"2"	"0"	"0"	"185.0841"	"NEUTRAL"	"C12H11NO"	"Cc1ccc(=O)n(-c2ccccc2)c1"
"CHEMBL4297643"	"APILIMOD"	"APILIMOD|STA 5326|STA-5326"	"Small molecule"	"2"	"418.50"	"2"	"7"	"3.08"	"84.76"	"8"	"1"	"0"	"8"	"N"	"0.44"	"None"	"5.89"	"4.82"	"4.79"	"3"	"MOL"	"0"	"31"	"8"	"1"	"0"	"418.2117"	"NEUTRAL"	"C23H26N6O2"	"Cc1cccc(/C=N/Nc2cc(N3CCOCC3)nc(OCCc3ccccn3)n2)c1"
"CHEMBL4298058"	"BEMPEGALDESLEUKIN"	"ALDESLEUKIN PRODRUG NKTR-214|BEMPEGALDESLEUKIN|NKTR 214|NKTR-214|NKTR-214 PRODRUG"	"Protein"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL253376"	"BROMHEXINE"	"BROMHEXINE|FLUIBRON"	"Small molecule"	"4"	"376.14"	"129"	"584"	"4.56"	"29.26"	"2"	"1"	"0"	"3"	"N"	"0.78"	"None"	"9.23"	"4.42"	"2.59"	"1"	"MOL"	"0"	"18"	"2"	"2"	"0"	"373.9993"	"BASE"	"C14H20Br2N2"	"CN(Cc1cc(Br)cc(Br)c1N)C1CCCCC1"
"CHEMBL1353"	"SODIUM BICARBONATE"	"B1654|BAKING SODA|BICARBONATE OF SODA|Baking Soda|CARBONIC ACID MONOSODIUM SALT|CARBONIC ACID SODIUM SALT (1:1)|E-500(II)|E500|GENITRON TP-BCH 51051|HYDROCEROL ESC 5671|INS NO.500(II)|INS-500(II)|Monosodium Carbonate|NABIC|NATRII HYDROGENOCARBONAS|NATRUM BICARBONICUM|NSC-134031|NURSE HARVEYS|Neut|S-BICARB|S-BICARB SF|SODIBIC|SODIUM ACID CARBONATE|SODIUM BICARBONATE|SODIUM BICARBONATE ANHYDROUS|Soda Mint|Sodium Bicarbonate|THAMICARB"	"Small molecule"	"4"	"84.01"	"21"	"165"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"0"	"None"	"None"	"None"	"None"	"83.9823"	"None"	"CHNaO3"	"O=C([O-])O.[Na+]"
"CHEMBL4297787"	"MONALIZUMAB"	"IPH-2201|IPH-2201 (ANTI-NKG2A)|IPH2201|MONALIZUMAB|NN-8765|NN8765|NN8765-3658"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4297879"	".ALPHA.1-PROTEINASE INHIBITOR HUMAN"	".ALPHA.-1 PROTEASE INHIBITOR|.ALPHA.1-ANTITRYPSIN|.ALPHA.1-PROTEINASE INHIBITOR HUMAN|ALFA1 ANTITRYPSIN|ALPHA 1-ANTITRYPSIN|ALPHA-1 PROTEASE INHIBITOR|ALPHA-1 PROTEINASE INHIBITOR (HUMAN)|ALPHA-1-ANTIPROTEINASE|ALPHA-1-ANTITRYPSIN|ALPHA1-PROTEINASE INHIBITOR|ALPHA1-PROTEINASE INHIBITOR (HUMAN)|ARALAST|ATC-B02AB02|GLASSIA|PROLASTIN|PROLASTIN-C|ZEMAIRA"	"Protein"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL154"	"NAPROXEN"	"ALEVE|ARTHROSIN 250|ARTHROSIN 250 EC|ARTHROSIN 500|ARTHROSIN 500 EC|Aleve|Anaprox|CONDROTEC|EC-NAPROSYN|Equiproxen|FEMINAX ULTRA|GRENOXAL|KENOSYN|LARAFLEX|NAPRATEC OP|NAPROSYN 375|NAPROSYN EC|NAPROXEN|NSC-750183|NSC-757239|NYCOPREN|Naprelan|Naprosyn|PN400 COMPONENT NAPROXEN|PRANOXEN CONTINUS|PROSAID|RHEUFLEX 250|RHEUFLEX 500|RIMOXYN|RS-3540|STIRLESCENT|TIMPRON|TIMPRON 250 EC|TIMPRON 500 EC|VALROX|VIMOVO"	"Small molecule"	"4"	"230.26"	"220"	"3504"	"3.04"	"46.53"	"2"	"1"	"0"	"3"	"N"	"0.88"	"4.19"	"None"	"2.99"	"-0.05"	"2"	"MOL"	"0"	"17"	"3"	"1"	"0"	"230.0943"	"ACID"	"C14H14O3"	"COc1ccc2cc([C@H](C)C(=O)O)ccc2c1"
"CHEMBL4297344"	"ABX-464"	"ABX-464|ABX464|OBEFAZIMOD|SPL-464"	"Small molecule"	"2"	"338.72"	"9"	"10"	"5.53"	"34.15"	"3"	"1"	"1"	"3"	"N"	"0.68"	"None"	"3.78"	"6.20"	"6.20"	"3"	"MOL"	"0"	"23"	"3"	"1"	"1"	"338.0434"	"NEUTRAL"	"C16H10ClF3N2O"	"FC(F)(F)Oc1ccc(Nc2ccc3cccc(Cl)c3n2)cc1"
"CHEMBL2095209"	"ICOSAPENT ETHYL"	"AMR 101|AMR-101|AMR101|EICOSAPENTAENOIC ACID ETHYL ESTER|EPADEL|ETHYL ICOSAPENT|ETHYL ICOSAPENTATE|ICOSAPENT ETHYL|ICOSAPENT ETHYL ESTER|NSC-759597|TIMNODONIC ACID ETHYL ESTER|VASCEPA"	"Small molecule"	"4"	"330.51"	""	""	"6.47"	"26.30"	"2"	"0"	"1"	"14"	"N"	"0.21"	"None"	"None"	"6.73"	"6.73"	"0"	"MOL"	"0"	"24"	"2"	"0"	"1"	"330.2559"	"None"	"C22H34O2"	"CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OCC"
"CHEMBL729"	"LOPINAVIR"	"A-157378-0|A-157378.0|ABT-378|ALUVIRAN|KOLETRA|Kaletra|LOPINAVIR|LOPINAVIR, (S-(2S,4S,5S))-|LOPINAVIR-|LOPINAVIRUM"	"Small molecule"	"4"	"628.81"	"67"	"840"	"4.33"	"120.00"	"5"	"4"	"1"	"15"	"N"	"0.20"	"13.39"	"None"	"4.69"	"4.69"	"3"	"MOL"	"0"	"46"	"9"	"4"	"1"	"628.3625"	"NEUTRAL"	"C37H48N4O5"	"Cc1cccc(C)c1OCC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C[C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)N1CCCNC1=O"
"CHEMBL1370"	"BUDESONIDE"	"AIRCORT|BUDEFLAM AQUANASE|BUDELIN NOVOLIZER|BUDENOFALK|BUDESONIDE|CORTIMENT|DUORESP SPIROMAX|ENTOCORT|ENTOCORT CR|ENTOCORT EC|MAP-0010|MAP0010|NSC-757788|ORTIKOS|PREFERID|PULMAXAN|PULMICORT FLEXHALER|PULMICORT L.S.|PULMICORT RESPULES|Pulmicort|R01AD05|RHINOCORT ALLERGY|RHINOCORT AQUA|RHINOCORT AQUA 64|Rhinocort|S-1320|SYMBICORT|UCERIS"	"Small molecule"	"4"	"430.54"	"161"	"545"	"2.72"	"93.06"	"6"	"2"	"0"	"4"	"N"	"0.71"	"13.75"	"None"	"2.73"	"2.73"	"0"	"MOL"	"0"	"31"	"6"	"2"	"0"	"430.2355"	"NEUTRAL"	"C25H34O6"	"CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@]2(C(=O)CO)O1"
"CHEMBL1201149"	"NALTREXONE HYDROCHLORIDE"	"ADEPEND|Depade|EN-1639A|EN-1639A (AS HYDROCHLORIDE)|NALOREX|NALTREXONE HCL|NALTREXONE HYDROCHLORIDE|OPIZONE|Revia|TREXAN"	"Small molecule"	"4"	"377.87"	"29"	"46"	"1.53"	"70.00"	"5"	"2"	"0"	"2"	"N"	"0.85"	"10.11"	"8.88"	"1.36"	"0.13"	"1"	"MOL"	"0"	"25"	"5"	"2"	"0"	"341.1627"	"BASE"	"C20H24ClNO4"	"Cl.O=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5"
"CHEMBL877"	"TRANEXAMIC ACID"	"AMCHA|CL 65336|CL-65336|CYCLO-F|CYCLOCAPRON|CYCLOKAPRON|CYKLO-F HEAVY PERIOD RELIEF|Cyklokapron|ESPERCIL|EXACYL|FEMSTRUAL|HAEMATRIX|LB-1148|LB1148|LYSTEDA|MENSTRALITE|NSC-291305|RIKAVARIN|RP-18429|TRANEXAMIC ACID|TRANS AMCHA|TRANS-AMCHA|TRANSAMIN|Trans AMCHA"	"Small molecule"	"4"	"157.21"	"121"	"673"	"0.84"	"63.32"	"2"	"2"	"0"	"2"	"N"	"0.62"	"4.56"	"10.22"	"-1.55"	"-1.55"	"0"	"MOL"	"0"	"11"	"3"	"3"	"0"	"157.1103"	"ZWITTERION"	"C8H15NO2"	"NC[C@H]1CC[C@H](C(=O)O)CC1"
"CHEMBL3707247"	"OZANIMOD"	"OZANIMOD|RPC-1063|RPC1063"	"Small molecule"	"4"	"404.47"	"20"	"37"	"3.63"	"104.20"	"7"	"2"	"0"	"7"	"N"	"0.62"	"None"	"8.96"	"3.96"	"2.39"	"3"	"MOL"	"0"	"30"	"7"	"2"	"0"	"404.1848"	"BASE"	"C23H24N4O3"	"CC(C)Oc1ccc(-c2nc(-c3cccc4c3CC[C@@H]4NCCO)no2)cc1C#N"
"CHEMBL160"	"CYCLOSPORINE"	"27-400|ANTIBIOTIC S-7481F1|ATOPICA|CAPIMUNE|CAPSORIN|CEQUA|CICLOSPORIN|CICLOSPORIN A|CICLOSPORINUM|CYCLOSPORIN|CYCLOSPORIN A|CYCLOSPORINE|CYCLOSPORINE A|CYCLOSPORINE MICROEMULSION|CYCLOSPORINE, MODIFIED|DEXIMUNE|EQUORAL|Gengraf|IKERVIS|MITOGARD|NEOPLANTA|NEUROSTAT|NSC-290193|Neoral|OL-27-400|OPTIMMUNE|RAMIHYPHIN A|RESTASIS MULTIDOSE|Restasis|SANDIMMUN|SANG-35|SANGCYA|SDZ-OXL-400|Sandimmune|VANQUORAL|VERKAZIA|ZINOGRAF ME"	"Protein"	"4"	"1202.63"	"266"	"4058"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"BOTH"	"0"	"None"	"None"	"None"	"None"	"1201.8414"	"None"	"C62H111N11O12"	"C/C=C/C[C@@H](C)[C@@H](O)[C@H]1C(=O)N[C@@H](CC)C(=O)N(C)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1C"
"CHEMBL4297690"	"NOGAPENDEKIN ALFA"	"ALT-803|IL-15N72D|N-803|NOGAPENDEKIN ALFA"	"Protein"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL112"	"ACETAMINOPHEN"	"ABDINE|ACETAMINOPHEN|ALVEDON|ANGIERS|APAP|Acephen|Acetaminophen|BIOCETAMOL|CALPOL|CALPOL SIX PLUS|CALPOL SIX PLUS FASTMELTS|CHILD LEMSIP|CUPANOL|DAFALGAN|DISPROL|DISPROL INFANT|DISPROL JNR|DISPROL PAED|DOLIPRANE|Datril|EFFERALGAN|FENNINGS|GALPAMOL|HEDEX|INFADROPS|Infants' Feverall|Injectapap|JUNIOR PARAPAED|MANDANOL|MEDINOL|MEDINOL FOR CHILDREN|MEDINOL OVER 6|MEDINOL UNDER 6|MEDISED PLAIN|MIRADOL|N-ACETYL-P-AMINOPHENOL|NSC-109028|NSC-3991|Neopap|OFIRMEV|P-HYDROXY-ACETANILID|PALDESIC|PANADOL|PANADOL ACTIFAST|PANADOL ACTIFAST SOLB|PANADOL ADVAN|PANADOL JNR|PANADOL OA|PANALEVE|PANALEVE 6 PLUS|PARACETAMOL|PARACETAMOLUM|PARAMIN|PARAPAED JNR|PARAPAED SIX PLUS|PARAVICT|PERFALGAN|PLACIDEX|Paracetamol|Phenaphen|RIMADOL|SALZONE|TIXYMOL|TRAMIL 500|Tylenol|VERMIDON"	"Small molecule"	"4"	"151.16"	"224"	"3076"	"1.35"	"49.33"	"2"	"2"	"0"	"1"	"Y"	"0.60"	"9.46"	"None"	"0.91"	"0.90"	"1"	"MOL"	"0"	"11"	"3"	"2"	"0"	"151.0633"	"NEUTRAL"	"C8H9NO2"	"CC(=O)Nc1ccc(O)cc1"
"CHEMBL1622"	"FOLIC ACID"	"ACIDUM FOLICUM|B03BB01|BIO SCIENCE|FOLACIN|FOLATE|FOLDINE|FOLETTES|FOLIAMIN|FOLIC ACID|FOLICARE|FOLIPAC|FOLSAN|Folic Acid|Folicet|Folvite|INCAFOLIC|LEXPEC|MILLAFOL|NATUR FLOW|NSC-3073|PRECONCEIVE|PTEROYLGLUTAMIC ACID|ROCHE|VITAMIN B9|VITAMIN BC|VITAMIN M|Vitamin Bc|Vitamin M"	"Small molecule"	"4"	"441.40"	"71"	"152"	"-0.04"	"213.28"	"9"	"6"	"1"	"9"	"N"	"0.26"	"3.32"	"2.09"	"-0.69"	"-6.93"	"3"	"MOL"	"0"	"32"	"13"	"7"	"2"	"441.1397"	"ACID"	"C19H19N7O6"	"Nc1nc(=O)c2nc(CNc3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)cnc2[nH]1"
"CHEMBL2108291"	"METENKEFALIN"	"(MET5)-ENKEPHALIN|ENKEPHALIN-(5-L-METHIONINE)|INNO-105|MET-ENKEPHALIN|METENKEFALIN|METHIONINE ENKEPHALIN|NSC-374896|OPIOID GROWTH FACTOR|SH-PENTAPEPTIDE-19|TYR-GLY-GLY-PHE-MET"	"Protein"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1161"	"MOMETASONE FUROATE"	"ASMANEX HFA|ASMANEX TWISTHALER|Asmanex|Elocon|LAS-41002|LAS41002|LYR-210|LYR210|MOMETASONE|MOMETASONE FUROATE|MOMETASONE FUROATE ANHYDROUS|MOMETASONE FUROATE HYDRATE|MOMETASONE FUROATE MONOHYDRATE|MONOVO|Mometasone furoate monohydrate|NASONEX|NSC-746171|NSC-760077|Nasonex|SCH 32088|SCH-32088|SINUVA"	"Small molecule"	"4"	"521.44"	"24"	"64"	"4.87"	"93.81"	"6"	"1"	"1"	"4"	"N"	"0.45"	"13.78"	"None"	"5.06"	"5.06"	"1"	"MOL"	"0"	"35"	"6"	"1"	"1"	"520.1419"	"NEUTRAL"	"C27H30Cl2O6"	"C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]2(C)[C@@]1(OC(=O)c1ccco1)C(=O)CCl"
"CHEMBL2447938"	"OZONE"	"OZONE|TRIATOMIC OXYGEN"	"Small molecule"	"3"	"48.00"	""	""	"-1.12"	"51.43"	"2"	"0"	"0"	"0"	"Y"	"0.20"	"-1.27"	"None"	"-0.21"	"-2.59"	"0"	"MOL"	"0"	"3"	"3"	"0"	"0"	"47.9847"	"ACID"	"O3"	"O=[O+][O-]"
"CHEMBL2109134"	"MOLGRAMOSTIM"	"GRANULOCYTE-MACROPHAGE COLONY-STIMULATING FACTOR MOLGRAMOSTIM|LEUCOMAX|MOLGRADEX|MOLGRAMOSTIM|MOLGRAMOSTIM (GENETICAL RECOMBINATION)|MOLGRAMOSTIM RDNA|SCH 39300|SCH-39300"	"Protein"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL545"	"ALCOHOL"	"ABLYSINOL|ALCOHOL|ALCOHOL 190 PROOF|ALCOHOL 95%|ALCOHOL ANHYDROUS|ALCOHOL DENAT.|ALCOHOL DENATURED|ALCOHOL DETERMINATION--ALCOHOL|ALCOHOL, ABSOLUTE|ALCOHOL, DEHYDRATED|ALCOHOL, DENATURED|ALCOHOL, DILUTED|ALCOHOL, RUBBING|ALCOHOL,DEHYDRATED|ALCOHOL,DENATURED|ALCOHOL,ETHYL|ALCOHOL,SDA|ALCOHOLUM|ANHYDROUS ETHANOL|Alcohol|Alcohol, Diluted|Alcohol, Rubbing|B3324|DEHYDRATED ALCOHOL|DEHYDRATED ETHANOL|E1510|EDIBLE ALCOHOL|ETHANOL|ETHANOL IN ALCOHOLIC BEVERAGES|ETHANOL, ANHYDROUS|ETHANOL, DEHYDRATED|ETHANOLUM|ETHYL ALCOHOL|ETHYL ALCOHOL, ABSOLUTE|ETHYL ALCOHOL, DEHYDRATED|ETHYLICUM|Ethanol|Ethyl Alcohol|FEMA NO. 2419|GRAIN ALCOHOL|METHYLATED MINERAL|NCI-C03134|NSC-85228|PM-6193-200|SD ALCOHOL|SPIRIGEL|SURG|TECSOL|VODKA"	"Small molecule"	"4"	"46.07"	"137"	"2763"	"0.00"	"20.23"	"1"	"1"	"0"	"0"	"Y"	"0.41"	"None"	"None"	"-0.16"	"-0.16"	"0"	"MOL"	"0"	"3"	"1"	"1"	"0"	"46.0419"	"NEUTRAL"	"C2H6O"	"CCO"
"CHEMBL932"	"DIPYRIDAMOLE"	"ATTIA|B01AC07|CEREBROVASE 100|CEREBROVASE 25|DIPYRIDAMOLE|IV PERSANTINE|MODAPLATE|NSC-515776|OFCRAM PR|PERSANTIN|PERSANTIN RET|PYRIDANTIN|Persantine|RA-8|VASYROL"	"Small molecule"	"4"	"504.64"	"283"	"993"	"-0.02"	"145.44"	"12"	"4"	"2"	"12"	"N"	"0.31"	"None"	"3.54"	"1.81"	"1.81"	"2"	"MOL"	"0"	"36"	"12"	"4"	"2"	"504.3173"	"NEUTRAL"	"C24H40N8O4"	"OCCN(CCO)c1nc(N2CCCCC2)c2nc(N(CCO)CCO)nc(N3CCCCC3)c2n1"
"CHEMBL2109042"	"INFLUENZA VIRUS VACCINE"	"FluShield|Fluogen|Fluzone|INFLUENZA VIRUS VACCINE|INFLUENZA, LIVE ATTENUATED"	"Unknown"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4297447"	"TRV-120027"	"SAR-VAL-TYR-ILE-HIS-PRO-D-ALA-OH|TRV 027|TRV-027|TRV-120027|TRV027|TRV120027"	"Protein"	"2"	"926.09"	"4"	"23"	"-1.91"	"355.05"	"12"	"13"	"3"	"26"	"N"	"0.03"	"3.80"	"11.48"	"-4.19"	"-5.13"	"2"	"MOL"	"0"	"66"	"23"	"14"	"3"	"925.5134"	"ZWITTERION"	"C43H67N13O10"	"CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O"
"CHEMBL1201431"	"DORNASE ALFA"	"DORNASE ALFA|DORNASE ALFA (DESOXYRIBONUCLEASE)|DORNASE ALFA, RDNA|DORNASE ALFA, RECOMBINANT|DORNASE ALFA,RDNA|DORNASE ALPHA|HUMAN DNASE-1|Pulmozyme"	"Enzyme"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1643"	"RIBAVIRIN"	"COTRONAK|Copegus|NSC-163039|RIBAVARIN|RIBAVIRIN|RIBAVIRIN BIOPARTNERS|RIBAVIRIN MYLAN|RIBAVIRIN TEVA|Rebetol|RibaPak|Ribasphere|Ribofluranosyl Carboxamide|SCH 18908|SCH-18908|TRIBAVIRIN|Tribavirin|VIRAZID|Viramid|Virazole"	"Small molecule"	"4"	"244.21"	"314"	"3415"	"-3.01"	"143.72"	"8"	"4"	"0"	"3"	"N"	"0.44"	"11.88"	"None"	"-2.77"	"-2.77"	"1"	"MOL"	"0"	"17"	"9"	"5"	"0"	"244.0808"	"NEUTRAL"	"C8H12N4O5"	"NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)n1"
"CHEMBL2108866"	"STARCH"	"BIO-SORB|STARCH"	"Oligosaccharide"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4802158"	"LARSUCOSTEROL"	"25HC3S|DUR-928|DV-928|LARSUCOSTEROL"	"Small molecule"	"2"	"482.73"	""	""	"6.33"	"83.83"	"4"	"2"	"1"	"7"	"N"	"0.33"	"-1.61"	"None"	"4.33"	"3.32"	"0"	"MOL"	"0"	"33"	"5"	"2"	"1"	"482.3066"	"ACID"	"C27H46O5S"	"C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](OS(=O)(=O)O)CC[C@]4(C)[C@H]3CC[C@@]21C"
"CHEMBL1485"	"ARGININE"	"ARGININE|Arginine|L-ARGININE|NSC-206269"	"Small molecule"	"4"	"174.20"	"53"	"164"	"-1.34"	"125.22"	"3"	"5"	"0"	"5"	"N"	"0.20"	"2.41"	"12.41"	"-3.16"	"-4.85"	"0"	"MOL"	"0"	"12"	"6"	"7"	"1"	"174.1117"	"ZWITTERION"	"C6H14N4O2"	"N=C(N)NCCC[C@H](N)C(=O)O"
"CHEMBL3990029"	"RISANKIZUMAB"	"655066-01|ABBV-066|BI-655066|BI655066|RISANKIZUMAB|RISANKIZUMAB-RZAA|Skyrizi"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2108589"	"CLAZAKIZUMAB"	"ALD-518|ALD518|BMS-945429|CLAZAKIZUMAB"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL157366"	"MOSEDIPIMOD"	"EC-18|MOSEDIPIMOD"	"Small molecule"	"2"	"634.98"	"1"	"2"	"11.30"	"78.90"	"6"	"0"	"2"	"33"	"N"	"0.03"	"None"	"None"	"12.61"	"12.61"	"0"	"MOL"	"0"	"45"	"6"	"0"	"2"	"634.5172"	"NEUTRAL"	"C39H70O6"	"CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC(COC(C)=O)COC(=O)CCCCCCCCCCCCCCC"
"CHEMBL1323"	"DARUNAVIR"	"DARUNAVIR|MC-114|PREZISTA|TMC 114|TMC-114|TMC-41629|TMC114|UIC-94017|UIC-940T"	"Small molecule"	"4"	"547.67"	"29"	"639"	"2.38"	"140.42"	"8"	"3"	"1"	"11"	"N"	"0.36"	"13.59"	"2.39"	"2.82"	"2.82"	"2"	"MOL"	"0"	"38"	"10"	"4"	"1"	"547.2352"	"NEUTRAL"	"C27H37N3O7S"	"CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12)S(=O)(=O)c1ccc(N)cc1"
"CHEMBL85164"	"CAMOSTAT MESILATE"	"CAMOSTAT MESILATE|CAMOSTAT MESYLATE|CAMOSTAT METHANESULFONATE|Camostat Mesilate"	"Small molecule"	"3"	"494.53"	"13"	"22"	"1.39"	"134.81"	"6"	"3"	"0"	"7"	"N"	"0.28"	"None"	"8.54"	"1.51"	"0.36"	"2"	"MOL"	"0"	"29"	"9"	"4"	"0"	"398.1590"	"BASE"	"C21H26N4O8S"	"CN(C)C(=O)COC(=O)Cc1ccc(OC(=O)c2ccc(NC(=N)N)cc2)cc1.CS(=O)(=O)O"
"CHEMBL4650358"	"ISUZINAXIB HYDROCHLORIDE"	"APX-115|EWHA-18278|ISUZINAXIB HYDROCHLORIDE"	"Small molecule"	"2"	"315.80"	""	""	"3.59"	"50.94"	"4"	"1"	"0"	"4"	"N"	"0.79"	"5.36"	"1.51"	"4.66"	"3.14"	"3"	"MOL"	"0"	"21"	"4"	"1"	"0"	"279.1372"	"ACID"	"C17H18ClN3O"	"CCCc1c(-c2ccccc2)nn(-c2ccccn2)c1O.Cl"
"CHEMBL25"	"ASPIRIN"	"8-HOUR BAYER|ACETYL SALICYLATE|ACETYLSALIC ACID|ACETYLSALICYLIC ACID|ACETYLSALICYLIC ACID (WHO-IP)|ACETYLSALICYLICUM ACIDUM|ACIDUM ACETYLSALICYLICUM|ALKA RAPID|ANADIN ALL NIGHT|ANGETTES 75|ASPIRIN|ASPRO CLR|Acetosalic Acid|Acetylsalicylic Acid|Aspirin|BAY1019036|BAYER EXTRA STRENGTH ASPIRIN FOR MIGRAINE PAIN|BENZOIC ACID, 2-(ACETYLOXY)-|DANAMEP|DISPRIN CV|DISPRIN DIRECT|DURLAZA|ENPRIN|Ecotrin|Equi-Prin|GENCARDIA|LEVIUS|MAX STRGH ASPRO CLR|MEASURIN|MICROPIRIN EC|NSC-27223|NSC-406186|NU-SEALS 300|NU-SEALS 600|NU-SEALS 75|NU-SEALS CARDIO 75|PAYNOCIL|PLATET|PLATET 300|POSTMI 300|POSTMI 75|Salicylic Acid Acetate|VAZALORE"	"Small molecule"	"4"	"180.16"	"305"	"3843"	"1.31"	"63.60"	"3"	"1"	"0"	"2"	"N"	"0.55"	"3.41"	"None"	"1.24"	"-2.16"	"1"	"MOL"	"0"	"13"	"4"	"1"	"0"	"180.0423"	"ACID"	"C9H8O4"	"CC(=O)Oc1ccccc1C(=O)O"
"CHEMBL1743070"	"SILTUXIMAB"	"CLLB8|CNTO-328|SILTUXIMAB|SYLVANT"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1201670"	"SARGRAMOSTIM"	"B1 61.012|B1-61012|GRANULOCYTE-MACROPHAGE COLONY-STIMULATING FACTOR SARGRAMOSTIM|Leukine|RHU GM-CSF|RHU-GM-CSF|SARGRAMOSTIM|SARGRAMOSTIM RDNA"	"Protein"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2016757"	"GS-441524"	"GS 441524|GS-441524|GS441524"	"Small molecule"	"1"	"291.27"	"26"	"40"	"-1.86"	"149.92"	"9"	"4"	"0"	"2"	"N"	"0.50"	"12.13"	"0.65"	"-1.88"	"-1.88"	"2"	"MOL"	"0"	"21"	"9"	"5"	"0"	"291.0968"	"NEUTRAL"	"C12H13N5O4"	"N#C[C@@]1(c2ccc3c(N)ncnn23)O[C@H](CO)[C@@H](O)[C@H]1O"
"CHEMBL2109330"	"IC14"	"ATIBUCLIMAB|IC-14|IC14"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL31574"	"FISETIN"	"5-DESOXYQUERCETIN|C.I. 75620|C.I. NATURAL BROWN 1|FISETIN|FISIDENOLON 1521|NSC-407010|NSC-656275"	"Small molecule"	"2"	"286.24"	"190"	"366"	"2.28"	"111.13"	"6"	"4"	"0"	"1"	"N"	"0.51"	"6.32"	"None"	"1.81"	"0.70"	"3"	"MOL"	"0"	"21"	"6"	"4"	"0"	"286.0477"	"ACID"	"C15H10O6"	"O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)ccc12"
"CHEMBL190461"	"CANNABIDIOL"	"(-)-CANNABIDIOL|(-)-CBD|(-)-TRANS-CANNABIDIOL|.DELTA.1(2)-TRANS-CANNABIDIOL|BTX-1204|BTX-1503|CANNABIDIOL|CANNABIDIOL SOLUTION|CBD|EPIDIOLEX|GWP-42003|GWP-42003-P|GWP42003|GWP42003-P"	"Small molecule"	"4"	"314.47"	"102"	"254"	"5.85"	"40.46"	"2"	"2"	"1"	"6"	"N"	"0.51"	"9.13"	"None"	"6.33"	"6.32"	"1"	"MOL"	"0"	"23"	"2"	"2"	"1"	"314.2246"	"NEUTRAL"	"C21H30O2"	"C=C(C)[C@@H]1CCC(C)=C[C@H]1c1c(O)cc(CCCCC)cc1O"
"CHEMBL1168"	"RAMIPRIL"	"Altace|C09AA05|CARDACE|CORPRIL|DELIX|ECATOR|HOE 498|HOE-498|HOPACE|LOPACE|NSC-758933|PRAMACE|RAMACE|RAMIPRES|RAMIPRIL|RANACE|TRIATEC|TRITACE|UNIPRIL|VESDIL"	"Small molecule"	"4"	"416.52"	"131"	"685"	"2.38"	"95.94"	"5"	"2"	"0"	"9"	"N"	"0.60"	"3.75"	"5.20"	"1.47"	"-0.18"	"1"	"MOL"	"0"	"30"	"7"	"2"	"0"	"416.2311"	"ACID"	"C23H32N2O5"	"CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1[C@H](C(=O)O)C[C@@H]2CCC[C@@H]21"
"CHEMBL384467"	"DEXAMETHASONE"	"AEROSEB-DEX|DECADERM|DECADRON-75|DECASPRAY|DEXACORTISYL|DEXAFREE|DEXAMETHASONE|DEXAMETHASONE INTENSOL|DEXAMETHASONE METASULFOBENZOATE SODIUM|DEXAMETHASONE PALMITATE|DEXAMETHASONE VALERATE|DEXONE 0.5|DEXONE 0.75|DEXONE 1.5|DEXONE 4|DEXSOL|DEXTENZA|DEXYCU|DEXYCU KIT|DROPODEX|Dalalone|Decadron|Decadron-LA|Dexacen-4|Dexacort|Dexair|Dexamethasone|Dexone|FLUORMETHYLPREDNISOLONE|GPPE EAR SPY|HEMADY|Hexadrol|ISV-305|Kortico Injection|MARTAPAN|MAXITROL|Maxidex|Mymethasone|NSC-34521|Neodecadron|ORADEXON|OTO-104|OTOMIZE|OZURDEX|SOFRADEX|SPERSADEX COMP|TOBRADEX"	"Small molecule"	"4"	"392.47"	"297"	"2916"	"1.90"	"94.83"	"5"	"3"	"0"	"2"	"N"	"0.67"	"12.42"	"None"	"1.68"	"1.68"	"0"	"MOL"	"0"	"28"	"5"	"3"	"0"	"392.1999"	"NEUTRAL"	"C22H29FO5"	"C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO"
"CHEMBL4065616"	"REMDESIVIR"	"GS 5734|GS-5734|REMDESIVIR|VEKLURY"	"Small molecule"	"4"	"602.59"	"25"	"81"	"2.31"	"203.55"	"13"	"4"	"2"	"13"	"N"	"0.16"	"10.23"	"0.59"	"2.01"	"2.01"	"3"	"MOL"	"0"	"42"	"14"	"5"	"2"	"602.2254"	"NEUTRAL"	"C27H35N6O8P"	"CCC(CC)COC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@@](C#N)(c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O)Oc1ccccc1"
"CHEMBL600"	"ACETYLCYSTEINE"	"5052|A-CYS|ACC-600|ACETYL CYSTEINE|ACETYLCYSTEINE|AIRBRON|Acetadote|BRONCHOLYSIN|CETYLEV|EN-CYS|FABROL|FLUIMICIL|FLUIMUCETIN|FLUIMUCIL|FLUIMUCIL 600|FLUIMUCIL LONG|FLUIMUCIL N|ILUBE|MERCAPTURIC ACID|MUCOSIL-10|MUCOSIL-20|Mucomyst|Mucosil|N-ACETYI-L-CYSTEINE|N-ACETYL-L-CYSTEINE|N-Acetyl-L-Cysteine|NSC-111180|ORISTAR NALC|ORONAC 600|PARVOLEX|RESPAIRE|RESPI-NAC|RK-0202|SIRAN|SOLMUCOL|SYNTEMUCOL|TIXAIR|YOURNAC"	"Small molecule"	"4"	"163.20"	"70"	"347"	"-0.49"	"66.40"	"3"	"3"	"0"	"3"	"N"	"0.49"	"3.82"	"None"	"-0.71"	"-3.97"	"0"	"MOL"	"0"	"10"	"4"	"2"	"0"	"163.0303"	"ACID"	"C5H9NO3S"	"CC(=O)N[C@@H](CS)C(=O)O"
"CHEMBL777"	"CLAVULANIC ACID"	"BRL 14151|BRL-14151|CLAVULANATE|CLAVULANIC ACID|Clavulanate|Clavulanic Acid|RX-10100|SERDAXIN"	"Small molecule"	"4"	"199.16"	"78"	"355"	"-1.10"	"87.07"	"4"	"2"	"0"	"2"	"N"	"0.55"	"3.32"	"None"	"-1.52"	"-4.94"	"0"	"MOL"	"0"	"14"	"6"	"2"	"0"	"199.0481"	"ACID"	"C8H9NO5"	"O=C(O)[C@H]1/C(=C/CO)O[C@@H]2CC(=O)N21"
"CHEMBL1393"	"SPIRONOLACTONE"	"ABBOLACTONE|Aldactone|CAROSPIR|DIATENSEC|GX SPIRONOL|LARACTONE|NSC-150399|SC-9420|SPIRETIC|SPIROCTAN 100|SPIROCTAN 25|SPIROCTAN 50|SPIRONOLACTONE|SPIRONOLACTONE CEVA|SPIRONOLACTONUM|SPIROSPARE 100|SPIROSPARE 25|Spironolactone|VEROSPIRONE"	"Small molecule"	"4"	"416.58"	"159"	"886"	"4.85"	"60.44"	"5"	"0"	"0"	"1"	"N"	"0.57"	"None"	"None"	"3.64"	"3.64"	"0"	"MOL"	"0"	"29"	"4"	"0"	"0"	"416.2021"	"NEUTRAL"	"C24H32O4S"	"CC(=O)S[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC[C@@]34CCC(=O)O4)[C@@H]21"
"CHEMBL506"	"PRIMAQUINE"	"KANAPRIM|MALIRIDE|NEO-QUIPENYL|NSC-27296|PRIMACHIN|PRIMAQUINE|Primaquine|SN-13272|WR-2975"	"Small molecule"	"4"	"259.35"	"179"	"1110"	"2.78"	"60.17"	"4"	"2"	"0"	"6"	"N"	"0.84"	"None"	"10.20"	"1.64"	"-0.96"	"2"	"MOL"	"0"	"19"	"4"	"3"	"0"	"259.1685"	"BASE"	"C15H21N3O"	"COc1cc(NC(C)CCCN)c2ncccc2c1"
"CHEMBL71"	"CHLORPROMAZINE"	"AMINAZINE|CHLORPROMAZINE|CHLORPROMAZINE HIBENZATE|CHLORPROMAZINE PHENOLPHTHALINATE|CHLORPROMAZINE TANNATE|CHLORPROMAZINUM|Chlorpromazine|ESMIND|Elmarin|FENACTIL|J2.794D|LARGACTILOTHIAZINE|Largactil|Megaphen|NOVOMAZINA|NSC-167745|NSC-226514|PROPAPHENIN|SANOPRON|SKF-2601A|Sonazine|Thorazine|WINTERMIN"	"Small molecule"	"4"	"318.87"	"267"	"3185"	"4.89"	"6.48"	"3"	"0"	"0"	"4"	"N"	"0.79"	"None"	"9.20"	"4.54"	"2.74"	"2"	"MOL"	"0"	"21"	"2"	"0"	"0"	"318.0957"	"BASE"	"C17H19ClN2S"	"CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc21"
"CHEMBL1256723"	"DOXYCYCLINE HYDROCHLORIDE"	"DOXYCYCLINE HCL|DOXYCYCLINE HYDROCHLORIDE|NSC-756751"	"Small molecule"	"3"	"480.90"	"23"	"43"	"-0.35"	"181.62"	"9"	"6"	"1"	"2"	"N"	"0.33"	"2.92"	"7.46"	"-3.29"	"-3.57"	"1"	"MOL"	"0"	"32"	"10"	"7"	"1"	"444.1533"	"ACID"	"C22H25ClN2O8"	"C[C@H]1c2cccc(O)c2C(=O)C2=C(O)[C@]3(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@@H]3[C@@H](O)[C@@H]21.Cl"
"CHEMBL1200969"	"DUTASTERIDE"	"AVOLVE|Avodart|DUASTRIDE|DUTASTERIDE|GG-745|GI 198745|GI-198745|NSC-740477|NSC-759880"	"Small molecule"	"4"	"528.54"	"16"	"60"	"6.58"	"58.20"	"2"	"2"	"2"	"2"	"N"	"0.43"	"12.56"	"None"	"5.79"	"5.79"	"1"	"MOL"	"0"	"37"	"4"	"2"	"2"	"528.2211"	"NEUTRAL"	"C27H30F6N2O2"	"C[C@]12CC[C@H]3[C@@H](CC[C@H]4NC(=O)C=C[C@]34C)[C@@H]1CC[C@@H]2C(=O)Nc1cc(C(F)(F)F)ccc1C(F)(F)F"
"CHEMBL3545185"	"SELINEXOR"	"KPT-330|SELINEXOR|Xpovio"	"Small molecule"	"4"	"443.31"	"3"	"9"	"3.39"	"97.62"	"7"	"2"	"0"	"5"	"N"	"0.36"	"12.17"	"1.22"	"3.07"	"3.07"	"3"	"MOL"	"0"	"31"	"8"	"2"	"0"	"443.0929"	"NEUTRAL"	"C17H11F6N7O"	"O=C(/C=C\n1cnc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1)NNc1cnccn1"
"CHEMBL1139"	"EPOPROSTENOL"	"ACT-385781A|EPOPROSTENOL|Epoprostenol|Flolan|PG-I2|PGI2|PGX|PROSTACYCLIN|PROSTAGLANDIN I2|PROSTAGLANDIN X|U-53,217|U-53217"	"Small molecule"	"4"	"352.47"	"10"	"53"	"3.41"	"86.99"	"4"	"3"	"0"	"10"	"N"	"0.41"	"4.43"	"None"	"2.42"	"-0.45"	"0"	"MOL"	"0"	"25"	"5"	"3"	"0"	"352.2250"	"ACID"	"C20H32O5"	"CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@@H]2O/C(=C\CCCC(=O)O)C[C@@H]21"
"CHEMBL1789941"	"RUXOLITINIB"	"INC-424|INC424|INCB-018424|INCB-18424|INCB018424|JAKAVI|RUXOLITINIB"	"Small molecule"	"4"	"306.37"	"511"	"987"	"3.47"	"83.18"	"5"	"1"	"0"	"4"	"N"	"0.80"	"13.89"	"3.91"	"2.48"	"2.48"	"3"	"MOL"	"0"	"23"	"6"	"1"	"0"	"306.1593"	"NEUTRAL"	"C17H18N6"	"N#CC[C@H](C1CCCC1)n1cc(-c2ncnc3[nH]ccc23)cn1"
"CHEMBL2109430"	"GIMSILUMAB"	"GIMSILUMAB|MORAb-022"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2095208"	"COBICISTAT"	"COBICISTAT|COBICISTAT ON SILICON DIOXIDE|GS-9350|TYBOST"	"Small molecule"	"4"	"776.04"	"9"	"10"	"6.00"	"138.02"	"10"	"3"	"2"	"19"	"N"	"0.11"	"None"	"6.69"	"4.99"	"4.91"	"4"	"MOL"	"0"	"54"	"12"	"3"	"3"	"775.3550"	"NEUTRAL"	"C40H53N7O5S2"	"CC(C)c1nc(CN(C)C(=O)N[C@@H](CCN2CCOCC2)C(=O)N[C@H](CC[C@H](Cc2ccccc2)NC(=O)OCc2cncs2)Cc2ccccc2)cs1"
"CHEMBL4297088"	"CHLORHEXIDINE GLUCONATE"	"ACRIFLEX|AEROCIDE 1|BACTICLENS|BIOSCRUB|BRIAN CARE|CEPTON|CETRICLENS|CETRICLENS FTE|CHG SCRUB|CHLOHEXIDINE GLUCONATE |CHLORAPREP|CHLORHEX GLUCON|CHLORHEXIDINE D-DIGLUCONATE|CHLORHEXIDINE DIGLUCONATE|CHLORHEXIDINE GLUCONATE|CLINIVEX|CORSODYL|CORSODYL DAILY|CORSODYL DAILY DEFENCE|CURASEPT|CX 1|CYTEAL|Cida-stat|DISPRAY 1|DISPRAY 2|Dyna-hex|E-Z SCRUB|ECZMOL|EXIDINE|GPPE SOLN|GPPE TINCT|GPPE WSH|HIBI|HIBICET|HIBIDIL|HIBISCRUB|HIBISPRAY|HIBITANE PLUS|HYDREX|Hibiclens|Hibistat|Microderm|NSC-753971|PAROEX|PERIO-KIN|PHISO-MED|PREVACARE R|PRIMAHEX|Peridex|Periochip|Periogard|Pharmaseal Scrub Care|Prevacare|READYPREP CHG|ROTERSEPT|SAVLOCLENS|SAVLODIL|SAVLON HC|SAVLON JNR|STERETS TISEPT|STERETS UNISCRUB|STERETS UNISEPT|STEREXIDINE|STERI-STAT|TARODENT|TISEPT|URIFLEX-C"	"Small molecule"	"4"	"897.77"	""	""	"4.18"	"167.58"	"4"	"10"	"2"	"9"	"N"	"0.14"	"None"	"10.45"	"4.51"	"-1.30"	"2"	"MOL"	"0"	"34"	"10"	"10"	"2"	"504.2032"	"BASE"	"C34H54Cl2N10O14"	"N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1.O=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.O=C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO"
"CHEMBL44657"	"ETOPOSIDE"	"ETOPOSIDE|ETOPOSIDE RESOLUTION MIXTURE|ETOPOSIDUM|NSC-141540|SINTOPOZID|TOPOSAR|VP-16-213|Vepesid"	"Small molecule"	"4"	"588.56"	"1006"	"6694"	"1.34"	"160.83"	"13"	"3"	"2"	"5"	"N"	"0.43"	"9.33"	"None"	"1.16"	"1.16"	"2"	"MOL"	"0"	"42"	"13"	"3"	"2"	"588.1843"	"NEUTRAL"	"C29H32O13"	"COc1cc([C@@H]2c3cc4c(cc3[C@@H](O[C@@H]3O[C@@H]5CO[C@@H](C)O[C@H]5[C@H](O)[C@H]3O)[C@H]3COC(=O)[C@H]23)OCO4)cc(OC)c1O"
"CHEMBL1473"	"FLUTICASONE PROPIONATE"	"AERIVIO SPIROMAX|AIRFLUSAL FORSPIRO|ARMONAIR DIGIHALER|ARMONAIR RESPICLICK|CCI 18781|CCI-18781|Cutivate|FLIXONASE|FLIXOTIDE|FLONASE ALLERGY RELIEF|FLOVENT|FLOVENT DISKUS 100|FLOVENT DISKUS 250|FLOVENT DISKUS 50|FLOVENT HFA|FLUTICAPS|FLUTICASONE|FLUTICASONE PROPIONATE|FLUTICASONE PROPIONATE |FLUTICASONE-17-PROPIONATE|FLUTIFORM|Flonase|Flovent|NASOFAN|NSC-759889|OPN-375|OPTINOSE|PF-00241939|PIRINASE|R01AD08|SEREFLO|SERETIDE 100|SERETIDE 125|SERETIDE 250|SERETIDE 50|SERETIDE 500|SIRDUPLA|XHANCE"	"Small molecule"	"4"	"500.58"	"38"	"1172"	"4.43"	"80.67"	"6"	"1"	"1"	"4"	"N"	"0.58"	"13.61"	"None"	"3.72"	"3.72"	"0"	"MOL"	"0"	"34"	"5"	"1"	"1"	"500.1844"	"NEUTRAL"	"C25H31F3O5S"	"CCC(=O)O[C@]1(C(=O)SCF)[C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C"
"CHEMBL305187"	"IFENPRODIL"	"IFENPRODIL|IFENPRODIL HEMITARTRATE|IFENPRODIL TARTRATE|NP-120|RC 61-91|RC-61-91|VADILEX"	"Small molecule"	"4"	"325.45"	"47"	"172"	"3.77"	"43.70"	"3"	"2"	"0"	"5"	"N"	"0.88"	"9.67"	"9.03"	"3.57"	"2.30"	"2"	"MOL"	"0"	"24"	"3"	"2"	"0"	"325.2042"	"BASE"	"C21H27NO2"	"CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1"
"CHEMBL742"	"KETAMINE"	"ANAKET V|CALYPSOL|CLORKETAM 1000|DL-KETAMINE|IMALGENE 1000|KETALAR|KETAMINE|KETASOL 100|Ketamine|NARKETAN|NSC-70151|PMI-150|TEKAM|URSOTAMIN|VETAKET"	"Small molecule"	"4"	"237.73"	"153"	"784"	"2.90"	"29.10"	"2"	"1"	"0"	"2"	"Y"	"0.86"	"None"	"7.16"	"3.35"	"3.15"	"1"	"MOL"	"0"	"16"	"2"	"1"	"0"	"237.0920"	"NEUTRAL"	"C13H16ClNO"	"CNC1(c2ccccc2Cl)CCCCC1=O"
"CHEMBL298470"	"TAFENOQUINE"	"SB-252263-AAB|TAFENOQUINE|WR 238605"	"Small molecule"	"4"	"463.50"	"17"	"146"	"5.91"	"78.63"	"6"	"2"	"1"	"9"	"N"	"0.41"	"None"	"10.20"	"4.97"	"2.37"	"3"	"MOL"	"0"	"33"	"6"	"3"	"1"	"463.2083"	"BASE"	"C24H28F3N3O3"	"COc1cc(C)c2c(Oc3cccc(C(F)(F)F)c3)c(OC)cc(NC(C)CCCN)c2n1"
"CHEMBL1771"	"CLOPIDOGREL"	"CLOPIDOGREL|CLOPIDOGREL 1A-PHARMA|CLOPIDOGREL ACINO|CLOPIDOGREL APOTEX|CLOPIDOGREL BENZENESULFONATE|CLOPIDOGREL BESILATE|CLOPIDOGREL BESYLATE|CLOPIDOGREL HEXAL|CLOPIDOGREL SANDOZ|CLOPIDOGREL-RATIOPHARM|Clopidogrel|GREPID|ISCOVER|NSC-758613|PLAVIX|R 130964|R-130964|SR 25990|SR-25990|ZYLLT"	"Small molecule"	"4"	"321.83"	"141"	"703"	"3.67"	"29.54"	"4"	"0"	"0"	"3"	"N"	"0.81"	"None"	"4.77"	"4.03"	"4.03"	"2"	"MOL"	"0"	"21"	"3"	"0"	"0"	"321.0590"	"NEUTRAL"	"C16H16ClNO2S"	"COC(=O)[C@H](c1ccccc1Cl)N1CCc2sccc2C1"
"CHEMBL3137343"	"PEMBROLIZUMAB"	"KEYLYNK-010 COMPONENT PEMBROLIZUMAB|KEYTRUDA|LAMBROLIZUMAB|MK-3475|PEMBROLIZUMAB|PEMBROLIZUMAB COMPONENT OF KEYLYNK-010|SCH-900475"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650461"	"CSL-324"	"ANUMIGILIMAB|CSL-324|CSL324"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650460"	"PLUTAVIMAB"	"AFFINITY MATURED COVI-GUARD|COVI-AMG|COVI-DROPS|PLUTAVIMAB|STI-2020|STI-2099|STI2020|STI2099"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1743050"	"OLOKIZUMAB"	"CDP-6038|CDP6038|OLOKIZUMAB|Olokizumab"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1682"	"SORBITOL"	"7B5697N|D-GLUCITOL|D-GLUCITOL SYRUP|D-SORBITOL|E 420|E-420(I)|E420|FEMA NO. 3029|GLUCITOL, D-|INS NO.420(I)|INS-420(I)|ISOMALT IMPURITY, SORBITOL-|NEOSORB P 60W|NSC-25944|SORBITOL|SORBITOL (E420)|SORBITOL SOLUTIONS|Sorbitol"	"Small molecule"	"4"	"182.17"	"11"	"23"	"-3.59"	"121.38"	"6"	"6"	"1"	"5"	"N"	"0.26"	"12.59"	"None"	"-3.73"	"-3.73"	"0"	"MOL"	"0"	"12"	"6"	"6"	"1"	"182.0790"	"NEUTRAL"	"C6H14O6"	"OC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO"
"CHEMBL405821"	"SENICAPOC"	"ICA-17043|PF-05416266|SENICAPOC|Senicapoc"	"Small molecule"	"3"	"323.34"	"18"	"35"	"3.78"	"43.09"	"1"	"1"	"0"	"4"	"N"	"0.73"	"None"	"None"	"4.46"	"4.46"	"3"	"MOL"	"0"	"24"	"2"	"2"	"0"	"323.1122"	"NEUTRAL"	"C20H15F2NO"	"NC(=O)C(c1ccccc1)(c1ccc(F)cc1)c1ccc(F)cc1"
"CHEMBL142438"	"NITROGEN"	"DINITROGEN|E-941|E941|INS NO.941|INS-941|MOLECULAR NITROGEN|NITROGEN|NITROGEN (N2)|NITROGEN GAS|NITROGEN, LIQUID|Nitrogen"	"Small molecule"	"4"	"28.01"	"1"	"1"	"0.03"	"47.58"	"2"	"0"	"0"	"0"	"Y"	"0.35"	"None"	"None"	"0.31"	"0.31"	"0"	"MOL"	"0"	"2"	"2"	"0"	"0"	"28.0061"	"None"	"N2"	"N#N"
"CHEMBL361497"	"ARTESUNATE"	".ALPHA.-ARTESUNIC ACID|ARTESUNATE|ARTESUNATUM|ARTESUNIC ACID|Arsumax|DIHYDROQINGHAOSU HEMISUCCINATE|LJPC-0118|NSC-712571|PLASMOTRIN|QINGHAOZHI|SAPHNATE|ZYSUNATE"	"Small molecule"	"4"	"384.43"	"89"	"733"	"2.60"	"100.52"	"7"	"1"	"0"	"4"	"N"	"0.58"	"3.77"	"None"	"3.10"	"-0.17"	"0"	"MOL"	"0"	"27"	"8"	"1"	"0"	"384.1784"	"ACID"	"C19H28O8"	"C[C@@H]1CC[C@H]2[C@@H](C)[C@H](OC(=O)CCC(=O)O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4"
"CHEMBL434394"	"NEBIVOLOL"	"HYPOLOC|NARBIVOLOL|NEBILET|NEBIVOLOL|R-65824|R65,824"	"Small molecule"	"4"	"405.44"	"10"	"36"	"2.36"	"70.95"	"5"	"3"	"0"	"6"	"N"	"0.69"	"13.52"	"8.90"	"3.21"	"1.71"	"2"	"MOL"	"0"	"29"	"5"	"3"	"0"	"405.1752"	"BASE"	"C22H25F2NO4"	"OC(CNCC(O)C1CCc2cc(F)ccc2O1)C1CCc2cc(F)ccc2O1"
"CHEMBL650"	"METHYLPREDNISOLONE"	"J3.872E|MEDRONE|METHYLPREDNISOLONE|Medrol|Methylprednisolone|NSC-19987|U-67,590A"	"Small molecule"	"4"	"374.48"	"215"	"509"	"1.80"	"94.83"	"5"	"3"	"0"	"2"	"N"	"0.69"	"12.59"	"None"	"1.56"	"1.56"	"0"	"MOL"	"0"	"27"	"5"	"3"	"0"	"374.2093"	"NEUTRAL"	"C22H30O5"	"C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)CO)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12"
"CHEMBL273264"	"NAFAMOSTAT"	"NAFAMOSTAT"	"Small molecule"	"3"	"347.38"	"26"	"60"	"2.65"	"138.07"	"4"	"5"	"0"	"4"	"N"	"0.21"	"None"	"11.32"	"2.52"	"-0.28"	"3"	"MOL"	"0"	"26"	"7"	"7"	"1"	"347.1382"	"BASE"	"C19H17N5O2"	"N=C(N)Nc1ccc(C(=O)Oc2ccc3cc(C(=N)N)ccc3c2)cc1"
"CHEMBL135"	"ESTRADIOL"	"17-.BETA.-OESTRADIOL|17-BETA-OESTRADIOL|17.BETA.-ESTRADIOL|17BETA-ESTRADIOL|ADGYN ESTRO|AGOFOLLIN|Alfatradiol|Alora|Aquagen|BEDOL|Climara|Climara Pro|DERMESTRIL 100|DERMESTRIL 25|DERMESTRIL 50|DERMESTRIL SEPTEM 25|DERMESTRIL SEPTEM 50|DERMESTRIL SEPTEM 75|DESTRADIOL|DIHYDROTHEELIN|DIHYDROXYESTRIN|DIVIGEL|Depo-Estradiol|E-Cypionate|ELESTRIN|ELLESTE SOLO|ELLESTE SOLO MX 40|ELLESTE SOLO MX 80|ESCLIM|ESTRADERM MX 100|ESTRADERM MX 25|ESTRADERM MX 50|ESTRADERM MX 75|ESTRADERM TTS 100|ESTRADERM TTS 25|ESTRADERM TTS 50|ESTRADIOL|ESTRADIOL 17-BETA|ESTRADIOL ANHYDROUS|ESTRADIOL HEMIHYDRATE|ESTRADIOL VALERATE METABOLITE E2|ESTRASORB|EVAMIST|EVOREL 100|EVOREL 25|EVOREL 50|EVOREL 75|Elestrim|Estrace|Estraderm|Estradiol|Estradiol hemihydrate|Estrasorb|Estring|Estrogel|FEMATRIX 40|FEMATRIX 80|FEMSEVEN 100|FEMSEVEN 50|FEMSEVEN 75|Fempatch|GYNERGON|GYNODIOL|GYNOESTRYL|Gvnodiol|Gynogen|IMVEXXY|Innofem|MENOREST 37.5|MENOREST 50|MENOREST 75|MENORING 50|MINIVELLE|Menostar|NSC-20293|NSC-9895|OESTRADIOL|Oestradiol|PROGYNOVA TS|SANDRENA|VIVELLE-DOT|Vagifem|Vagifem 18|Vagifem 8|Vivelle|WC-3011|WC3011|ZUMENON"	"Small molecule"	"4"	"272.39"	"283"	"3236"	"3.61"	"40.46"	"2"	"2"	"0"	"0"	"N"	"0.76"	"10.33"	"None"	"3.75"	"3.74"	"1"	"MOL"	"0"	"20"	"2"	"2"	"0"	"272.1776"	"NEUTRAL"	"C18H24O2"	"C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC[C@@H]2O"
"CHEMBL1908391"	"MASITINIB"	"AB-1010|AB1010|Kinavet|MASICAN|MASITINIB|MASITINIB MESILATE|MASITINIB MESYLATE|MASITINIB METHANESULFONATE|MASIVIERA|Masitinib|Masivet"	"Small molecule"	"3"	"498.66"	"484"	"761"	"5.26"	"73.39"	"7"	"2"	"1"	"7"	"N"	"0.36"	"12.70"	"7.84"	"4.97"	"4.39"	"4"	"MOL"	"0"	"36"	"7"	"2"	"1"	"498.2202"	"NEUTRAL"	"C28H30N6OS"	"Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nc(-c2cccnc2)cs1"
"CHEMBL1201563"	"INTERFERON BETA-1B"	"BAY 86-5046|BAY-86-5046|Betaseron|Extavia|INTERFERON BETA-1B"	"Protein"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650491"	"CX-024414"	"CX-024414|ELASOMERAN|M-1273|MODERNA COVID-19 VACCINE RNA|MRNA-1273|TAK-919"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4298075"	"PROPOLIS WAX"	"BEE PROPOLIS|FENGJIAO|PROPOLIS|PROPOLIS CERA|PROPOLIS WAX"	"Small molecule"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4297349"	"ASPARTYL-ALANYL-DIKETOPIPERAZINE"	"AMPION|ASPARTYL-ALANYL-DIKETOPIPERAZINE|DA-DKP"	"Small molecule"	"3"	"186.17"	""	""	"-1.54"	"95.50"	"3"	"3"	"0"	"2"	"N"	"0.49"	"4.02"	"None"	"-1.71"	"-4.86"	"0"	"MOL"	"0"	"13"	"6"	"3"	"0"	"186.0641"	"ACID"	"C7H10N2O4"	"C[C@@H]1NC(=O)[C@H](CC(=O)O)NC1=O"
"CHEMBL4206119"	"UPAMOSTAT"	"MESUPRON|UPAMOSTAT|WX-671"	"Small molecule"	"2"	"629.82"	"4"	"6"	"4.34"	"154.63"	"7"	"3"	"1"	"11"	"N"	"0.14"	"8.24"	"4.96"	"4.85"	"4.78"	"2"	"MOL"	"0"	"44"	"11"	"4"	"2"	"629.3247"	"NEUTRAL"	"C32H47N5O6S"	"CCOC(=O)N1CCN(C(=O)[C@H](Cc2cccc(/C(N)=N/O)c2)NS(=O)(=O)c2c(C(C)C)cc(C(C)C)cc2C(C)C)CC1"
"CHEMBL4650518"	"PLONMARLIMAB"	"PLONMARLIMAB|TJ-003234|TJ003234|TJM-2"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1743071"	"SIRUKUMAB"	"CNTO 136|CNTO-136|SIRUKUMAB|Sirukumab"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1200928"	"ZINC ACETATE"	"E650|Galzin|NPC-02|NSC-75801|ZINC ACETATE DIHYDRATE|ZINC ACETATE HYDRATE|Zinc acetate"	"Small molecule"	"4"	"183.48"	"2"	"5"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"0"	"None"	"None"	"None"	"None"	"181.9558"	"None"	"C4H6O4Zn"	"CC(=O)[O-].CC(=O)[O-].[Zn+2]"
"CHEMBL1201225"	"IODINE"	"IODINE|IODINE MILD|IODINE STRONG|IODIUM|IODUM|JODOSAN|NSC-42355|TEGODYNE"	"Small molecule"	"4"	"253.81"	"1"	"14"	"1.77"	"0.00"	"0"	"0"	"0"	"0"	"Y"	"0.58"	"None"	"None"	"1.36"	"1.36"	"0"	"MOL"	"0"	"2"	"0"	"0"	"0"	"253.8089"	"None"	"I2"	"II"
"CHEMBL812"	"PYRIDOSTIGMINE BROMIDE"	"KALIMIN|KALYMIN|Kalymin|MESTINON 10|MESTINON RET|Mestinon|NSC-679759|NSC-758435|PYRIDOSTIGMINE BROMIDE|PYRIDOSTIGMINI BROMIDUM|Pyridostigmine Bromide|RO-1-5130|Regonal|Regonol"	"Small molecule"	"4"	"261.12"	"82"	"103"	"0.57"	"33.42"	"2"	"0"	"0"	"1"	"Y"	"0.59"	"None"	"None"	"-3.47"	"-3.47"	"1"	"MOL"	"0"	"13"	"4"	"0"	"0"	"181.0972"	"NEUTRAL"	"C9H13BrN2O2"	"CN(C)C(=O)Oc1ccc[n+](C)c1.[Br-]"
"CHEMBL1200500"	"BECLOMETHASONE DIPROPIONATE"	"AEROBEC 100|AEROBEC 50|AEROBEC FTE 250|ASMABEC CLICKHALER|ASMABEC SPACEHALER|BECLAZONE 100|BECLAZONE 100 E-BREATHE|BECLAZONE 200|BECLAZONE 250|BECLAZONE 250 E-BREATHE|BECLAZONE 50|BECLAZONE 50 E-BREATHE|BECLOAQUA 50|BECLOFORTE|BECLOFORTE E-BREATHE|BECLOFORTE INTEGRA|BECLOFORTE-VM|BECLOMET DIPROP|BECLOMET HAYFEVER|BECLOMETASONE|BECLOMETASONE DIPROPIONATE|BECLOMETHASONE|BECLOMETHASONE DIPROPIONATE|BECLOMETHASONE DIPROPIONATE MONOHYDRATE|BECLOMIST|BECLOTAIDE|BECODISKS|BECONASE AQ|BECOTIDE|BECOTIDE 100|BECOTIDE 100 E-BREATHE|BECOTIDE 200|BECOTIDE 50|BECOTIDE 50 E-BREATHE|Beclovent|Beconase|CLENIL MODULITE|CLIPPER|FILAIR 100|FILAIR 50|FILAIR FTE|FOSTAIR|FOSTAIR NEXTHALER|NASOBEC AQ|NASOBEC HAYFEVER|NSC-755901|PROPADERM|PROPADERM FTE|PROPADERM-A|PROPADERM-C|PULVINAL BECLOMET|QNASL|QVAR 100|QVAR 100 E-BREATHE|QVAR 40|QVAR 50|QVAR 50 E-BREATHE|QVAR 80|QVAR REDIHALER|RINO CLENIL|SCH 18020W|SCH 8020W|SCH-18020W|SGX-201|SGX-202|SGX-203|VANCENASE AQ|VANCENASE POCKETHALER|VANCERIL DOUBLE STRENGTH|VENTIDE|VIVABEC|Vancenase|Vanceril|ZONIVENT AQUANASAL"	"Small molecule"	"4"	"521.05"	"31"	"68"	"4.09"	"106.97"	"7"	"1"	"1"	"6"	"N"	"0.41"	"13.81"	"None"	"4.43"	"4.43"	"0"	"MOL"	"0"	"36"	"7"	"1"	"1"	"520.2228"	"NEUTRAL"	"C28H37ClO7"	"CCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@@]21C"
"CHEMBL304087"	"MERIMEPODIB"	"MERIMEPODIB|VI-21,497|VI-21497|VX-497"	"Small molecule"	"2"	"452.47"	"10"	"25"	"4.01"	"123.95"	"7"	"3"	"0"	"7"	"N"	"0.49"	"11.22"	"0.57"	"1.94"	"1.94"	"3"	"MOL"	"0"	"33"	"10"	"3"	"0"	"452.1696"	"NEUTRAL"	"C23H24N4O6"	"COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1"
"CHEMBL4650299"	"HEPARIN"	"B01AB10|HEPARIN|HEPARIN, PORCINE"	"Oligosaccharide"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1743033"	"ITOLIZUMAB"	"BMAB-600|EQ001|ITOLIZUMAB|Itolizumab"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1201202"	"FONDAPARINUX"	"FONDAPARINUX|Fondaparinux"	"Oligosaccharide"	"4"	"1508.27"	"1"	"1"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"0"	"None"	"None"	"None"	"None"	"1506.9513"	"None"	"C31H53N3O49S8"	"CO[C@H]1O[C@H](COS(=O)(=O)O)[C@@H](O[C@@H]2O[C@@H](C(=O)O)[C@@H](O[C@H]3O[C@H](COS(=O)(=O)O)[C@@H](O[C@@H]4O[C@H](C(=O)O)[C@@H](O[C@H]5O[C@H](COS(=O)(=O)O)[C@@H](O)[C@H](O)[C@H]5NS(=O)(=O)O)[C@H](O)[C@H]4O)[C@H](OS(=O)(=O)O)[C@H]3NS(=O)(=O)O)[C@H](O)[C@H]2OS(=O)(=O)O)[C@H](O)[C@H]1NS(=O)(=O)O"
"CHEMBL4802159"	"ENPATORAN"	"ENPATORAN|M-5049|M5049"	"Small molecule"	"2"	"320.32"	""	""	"2.82"	"65.94"	"4"	"1"	"0"	"1"	"N"	"0.88"	"None"	"9.85"	"2.47"	"0.09"	"2"	"MOL"	"0"	"23"	"4"	"2"	"0"	"320.1249"	"BASE"	"C16H15F3N4"	"N#Cc1ccc(N2C[C@@H](C(F)(F)F)C[C@@H](N)C2)c2cccnc12"
"CHEMBL4297886"	"ASUNERCEPT"	"APG-101|APG101|APOCEPT|ASINERCEPT|ASUNERCEPT|CAN-008"	"Protein"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL885"	"EMTRICITABINE"	"(-)-EMTRICITABINE|(-)-FTC|524-W-91|524W91|BIKTARVY|BW-524W91|COVIRACIL|EMTRICITABINE|EMTRICITABINE, (-)-|EMTRICITABINUM|Emtriva|FTC|FTC-(-)"	"Small molecule"	"4"	"247.25"	"31"	"220"	"-0.46"	"90.37"	"7"	"2"	"0"	"2"	"N"	"0.73"	"None"	"None"	"-0.90"	"-0.90"	"1"	"MOL"	"0"	"16"	"6"	"3"	"0"	"247.0427"	"NEUTRAL"	"C8H10FN3O3S"	"Nc1nc(=O)n([C@@H]2CS[C@H](CO)O2)cc1F"
"CHEMBL902"	"FAMOTIDINE"	"AMFAMOX|FADUL|FAMODIL|FAMOSAN|FAMOTIDINE|FAMOTIDINE PRESERVATIVE FREE|FAMOTIDINE PRESERVATIVE FREE (PHARMACY BULK)|FAMOXAL|Fluxid|GANOR|GASTRIDIN|GASTROPEN|L 643341|LECEDIL|MK-208|MOTIAX|MUCLOX|NSC-757810|PEPCID AC|PEPCID PRESERVATIVE FREE|PEPCID RPD|PEPCIDAC|PEPDINE|PEPDUL|Pepcid|YM-11170"	"Small molecule"	"4"	"337.46"	"176"	"2091"	"-0.77"	"175.83"	"6"	"4"	"0"	"7"	"N"	"0.29"	"9.29"	"8.38"	"-1.95"	"-2.67"	"1"	"MOL"	"0"	"20"	"9"	"8"	"1"	"337.0449"	"NEUTRAL"	"C8H15N7O2S3"	"NC(N)=Nc1nc(CSCC/C(N)=N/S(N)(=O)=O)cs1"
"CHEMBL468"	"THALIDOMIDE"	".ALPHA.-PHTHALIMIDOGLUTARIMIDE|CELGENE|CONTERGAN|DISTAVAL|K-17|MYRIN|N-PHTHALYLGLUTAMIC ACID IMIDE|NEUROSEDYN|NSC-527179|NSC-66847|PANTOSEDIV|PHARMION|SOFTENON|TALIDEX|THALED|THALIDOMIDE|THALIDOMIDE |Thalomid"	"Small molecule"	"4"	"258.23"	"222"	"788"	"0.09"	"83.55"	"4"	"1"	"0"	"1"	"N"	"0.72"	"11.59"	"None"	"0.02"	"0.02"	"1"	"MOL"	"0"	"19"	"6"	"1"	"0"	"258.0641"	"NEUTRAL"	"C13H10N2O4"	"O=C1CCC(N2C(=O)c3ccccc3C2=O)C(=O)N1"
"CHEMBL3"	"NICOTINE"	"HABITROL|NICABATE|NICODERM CQ|NICOPASS|NICOPATCH|NICORETTE INVISI|NICOTINE|NICOTINELL CLASSIC|NICOTINELL SUPPORT|NICOTINELL TTS 10|NICOTINELL TTS 20|NICOTINELL TTS 30|NIQUITIN|NIQUITIN CLR|NIQUITIN MINIS CHERRY|NIQUITIN MINIS MINT|NIQUITIN MINIS ORANGE|NIQUITIN MINT|NIQUITIN PRE-QUIT|NIQUITIN STRIPS MINT|Nicoderm|Nicotine|Nicotrol|Nicotrol Inhaler|Nicotrol NS|PROSTEP|STOPPERS|STUBIT"	"Small molecule"	"4"	"162.24"	"216"	"1692"	"1.85"	"16.13"	"2"	"0"	"0"	"1"	"Y"	"0.63"	"None"	"8.58"	"1.16"	"-0.04"	"1"	"MOL"	"0"	"12"	"2"	"0"	"0"	"162.1157"	"BASE"	"C10H14N2"	"CN1CCC[C@H]1c1cccnc1"
"CHEMBL2107862"	"RINTATOLIMOD"	"ATVOGEN|Ampligen|POLY I : POLY C12U|POLY I: POLY C12U|RINTATOLIMOD"	"Oligonucleotide"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL3707348"	"ACALABRUTINIB"	"ACALABRUTINIB|ACP-196|CALQUENCE"	"Small molecule"	"4"	"465.52"	"19"	"92"	"3.31"	"118.51"	"7"	"2"	"0"	"4"	"N"	"0.45"	"None"	"4.63"	"2.56"	"2.56"	"4"	"MOL"	"0"	"35"	"9"	"3"	"0"	"465.1913"	"NEUTRAL"	"C26H23N7O2"	"CC#CC(=O)N1CCC[C@H]1c1nc(-c2ccc(C(=O)Nc3ccccn3)cc2)c2c(N)nccn12"
"CHEMBL4802210"	"BEBTELOVIMAB"	"BEBTELOVIMAB|LY-3853113|LY-CoV1404|LY3853113"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL314854"	"FINGOLIMOD"	"FINGOLIMOD|FTY-720|Fingolimod|GILENYA"	"Small molecule"	"4"	"307.48"	"40"	"348"	"3.20"	"66.48"	"3"	"3"	"0"	"12"	"N"	"0.52"	"None"	"9.38"	"4.06"	"2.12"	"1"	"MOL"	"0"	"22"	"3"	"4"	"0"	"307.2511"	"BASE"	"C19H33NO2"	"CCCCCCCCc1ccc(CCC(N)(CO)CO)cc1"
"CHEMBL567597"	"ARTEMISININ"	"(+)-Artemisinin|ARTEMISININ|ARTEMISININUM|Artemisin|GNF-PF-5341|HUANGHUAHAOSU|NSC-369397|QING HAU SAU"	"Small molecule"	"4"	"282.34"	"219"	"2158"	"2.39"	"53.99"	"5"	"0"	"0"	"0"	"N"	"0.50"	"None"	"None"	"3.11"	"3.11"	"0"	"MOL"	"0"	"20"	"5"	"0"	"0"	"282.1467"	"NEUTRAL"	"C15H22O5"	"C[C@@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4"
"CHEMBL221959"	"TOFACITINIB"	"550|CP 690550|CP- 690 550|CP-690|CP-690 FREE BASE|CP-690,550|CP-690,550 FREE BASE|CP-690-550|CP-690550|CP-690550 FREE BASE|CP690,550|CP690550|TASOCITINIB|TOFACITINIB"	"Small molecule"	"4"	"312.38"	"517"	"1695"	"1.54"	"88.91"	"5"	"1"	"0"	"3"	"N"	"0.93"	"9.15"	"6.44"	"1.24"	"1.19"	"2"	"MOL"	"0"	"23"	"7"	"1"	"0"	"312.1699"	"NEUTRAL"	"C16H20N6O"	"C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c1ncnc2[nH]ccc12"
"CHEMBL1448"	"NICLOSAMIDE"	"BAY 2353|BAY-2353|Ex A Lint|Lintex|NICLOSAMIDE|NICLOSAMIDE (ANHYDROUS)|NICLOSAMIDE ANHYDROUS|NICLOSAMIDE, ANHYDROUS|NICLOSAMIDUM ANHYDROUS|NSC-178296|Niclocide|Nicloside|WR 46234|YOMESAN"	"Small molecule"	"4"	"327.12"	"167"	"662"	"3.86"	"92.47"	"4"	"2"	"0"	"3"	"N"	"0.66"	"6.89"	"None"	"3.91"	"3.29"	"2"	"MOL"	"0"	"21"	"6"	"2"	"0"	"325.9861"	"NEUTRAL"	"C13H8Cl2N2O4"	"O=C(Nc1ccc([N+](=O)[O-])cc1Cl)c1cc(Cl)ccc1O"
"CHEMBL2108086"	"SULODEXIDE"	"SULODEXIDE|VESSEL DUE F"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650455"	"GANULAMERAN"	"BNT-162B3|BNT162B3|GANULAMERAN"	"Unknown"	"1"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1234886"	"OXYGEN"	"DIOXYGEN|E-948|E948|INS NO.948|INS-948|MOLECULAR OXYGEN|OXYGEN|OXYGEN 93 PERCENT|OXYGEN MOLECULE|OXYGENIUM|Oxygen|RNS-60 COMPONENT OXYGEN|RNS60 COMPONENT OXYGEN"	"Small molecule"	"4"	"32.00"	"6"	"8"	"0.07"	"34.14"	"2"	"0"	"0"	"0"	"Y"	"0.38"	"None"	"None"	"-0.28"	"-0.28"	"0"	"MOL"	"0"	"2"	"2"	"0"	"0"	"31.9898"	"None"	"O2"	"O=O"
"CHEMBL1201828"	"ECULIZUMAB"	"5G1.1|ABP-959|ALEXION|ECULIZUMAB|ELIZARIA|H5G1-1|H5G1.1|H5G1.1VHC+H5G1.1VLC|H5G11|SOLIRIS"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL231779"	"APIXABAN"	"APIXABAN|BMS-562247|BMS-562247-01|ELIQUIS"	"Small molecule"	"4"	"459.51"	"23"	"137"	"2.70"	"110.76"	"6"	"1"	"0"	"5"	"N"	"0.63"	"13.07"	"None"	"1.83"	"1.83"	"3"	"MOL"	"0"	"34"	"9"	"2"	"0"	"459.1907"	"NEUTRAL"	"C25H25N5O4"	"COc1ccc(-n2nc(C(N)=O)c3c2C(=O)N(c2ccc(N4CCCCC4=O)cc2)CC3)cc1"
"CHEMBL2108675"	"DUPILUMAB"	"DUPILUMAB|DUPIXENT|Dupilumab|REGN-668|REGN668|REGN668, SAR231893|SAR-231893|SAR231893"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL165"	"RESVERATROL"	"(E)-RESVERATROL|3,5,4'-Trihydroxy-trans-stilbene|BIA 6-512|BIA-6-512|BIOFORT|CA 1201|CUSPIDATIN|MELINJO RESVERATROL 20|NSC-327430|POLYGONIN|RESVERATROL|RESVERATROL P 5|RESVERATROL(E)-FORM|RESVIDA|SRT 501M|TRANS-RESVERATROL"	"Small molecule"	"3"	"228.25"	"451"	"2560"	"2.97"	"60.69"	"3"	"3"	"0"	"2"	"N"	"0.69"	"8.49"	"None"	"3.40"	"3.37"	"2"	"MOL"	"0"	"17"	"3"	"3"	"0"	"228.0786"	"NEUTRAL"	"C14H12O3"	"Oc1ccc(/C=C/c2cc(O)cc(O)c2)cc1"
"CHEMBL4594590"	"EFINEPTAKIN ALFA"	"EFINEPTAKIN ALFA|HYLEUKIN|NT-I7|RECOMBINANT HUMAN IL-7-HYFC (NT-I7)"	"Protein"	"1"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL195591"	"CO-TRIMOXAZOLE"	"CO-TRIMOXAZOLE|COTRIMOXAZOLE"	"Small molecule"	"3"	"542.62"	"4"	"38"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"0"	"None"	"None"	"None"	"None"	"542.1948"	"None"	"C25H30N6O6S"	"COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC.Cc1cc(CS(=O)(=O)c2ccc(N)cc2)no1"
"CHEMBL74415"	"CANNABINOL"	"CANNABINOL|NSC-134455"	"Small molecule"	"3"	"310.44"	"32"	"71"	"5.73"	"29.46"	"2"	"1"	"1"	"4"	"N"	"0.73"	"9.32"	"None"	"6.41"	"6.41"	"2"	"MOL"	"0"	"23"	"2"	"1"	"1"	"310.1933"	"NEUTRAL"	"C21H26O2"	"CCCCCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2"
"CHEMBL1690"	"HYDROXYCHLOROQUINE SULFATE"	"ERCOQUIN|Ercoquin|HYDROXYCHLOROQUINE SULFATE|HYDROXYCHLOROQUINE SULPHATE|Hydroxychloroquine Sulfate|NSC-4375|OXICHLOROCHINE SULFATE|OXIKLORIN|Oxichlorochine|Plaquenil|QUENSYL|QUINORIC|Quensyl|TCMDC-123987"	"Small molecule"	"4"	"433.96"	"19"	"69"	"3.78"	"48.39"	"4"	"2"	"0"	"9"	"N"	"0.73"	"None"	"9.76"	"2.89"	"0.33"	"2"	"MOL"	"0"	"23"	"4"	"2"	"0"	"335.1764"	"BASE"	"C18H28ClN3O5S"	"CCN(CCO)CCCC(C)Nc1ccnc2cc(Cl)ccc12.O=S(=O)(O)O"
"CHEMBL3545347"	"TXA127"	"5-ILE-ANGIOTENSIN-(1-7)|ANGIOTENSIN (1-7)|ANGIOTENSIN 1-7|ANGIOTENSIN FRAGMENT 1-7|ANGIOTENSIN PEPTIDE (1-7)|ANGIOTENSIN-(1-7)|ASP-ARG-VAL-TYR-ILE-HIS-PRO|BF-ANGIOTENSIN 1-7|HUMAN ANGIOTENSIN II (1-7)|SH-HEPTAPEPTIDE-13|TXA-127|TXA127"	"Protein"	"2"	"899.02"	"2"	"7"	"-1.83"	"377.24"	"12"	"13"	"3"	"25"	"N"	"0.03"	"3.35"	"11.46"	"-6.34"	"-6.31"	"2"	"BOTH"	"0"	"64"	"23"	"15"	"3"	"898.4661"	"ZWITTERION"	"C41H62N12O11"	"CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)O"
"CHEMBL2108723"	"PEGINTERFERON LAMBDA-1A"	"BMS-914143|BMS914143|PEG-IL-29|PEG-RIL-29|PEG-RLL-29|PEGINTERFERON LAMBDA-1A|PEGYLATED INTERFERON LAMBDA"	"Protein"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2108778"	"POLIOVIRUS VACCINE LIVE ORAL"	"Orimune|POLIOVIRUS VACCINE LIVE ORAL"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL3298910"	"TELACEBEC"	"Q-203|Q203|TELACEBEC"	"Small molecule"	"2"	"557.02"	"35"	"116"	"6.76"	"58.87"	"5"	"1"	"2"	"7"	"N"	"0.27"	"None"	"5.42"	"6.72"	"6.72"	"4"	"MOL"	"0"	"39"	"6"	"1"	"2"	"556.1853"	"NEUTRAL"	"C29H28ClF3N4O2"	"CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1"
"CHEMBL3707325"	"LENZILUMAB"	"KB-003|KB003|LENZILUMAB"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL192"	"SILDENAFIL"	"APHRODIL|HIP-0908|HIP0908|NIPATRA|PATREX|REVATIO|SILDENAFIL|SILDENAFIL ACTAVIS|SILDENAFIL RATIOPHARM|SILDENAFIL TEVA|Sildenafil|UK-92480|VIAGRA|VIZARSIN"	"Small molecule"	"4"	"474.59"	"190"	"1551"	"1.61"	"113.42"	"8"	"1"	"0"	"7"	"N"	"0.55"	"7.63"	"5.98"	"1.23"	"1.16"	"3"	"MOL"	"0"	"33"	"10"	"1"	"0"	"474.2049"	"NEUTRAL"	"C22H30N6O4S"	"CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCN(C)CC4)ccc3OCC)nc12"
"CHEMBL607023"	"TEMPOL"	"4-OXYPIPERIDOL|MBM-02|NSC-142784|SPJ-701|TANOL|TEMPOL|ZJ-701"	"Small molecule"	"2"	"172.25"	"16"	"30"	"1.35"	"43.37"	"2"	"1"	"0"	"0"	"Y"	"0.60"	"None"	"None"	"0.22"	"0.22"	"0"	"MOL"	"0"	"12"	"3"	"1"	"0"	"172.1338"	"NEUTRAL"	"C9H18NO2"	"CC1(C)CC(O)CC(C)(C)N1[O]"
"CHEMBL2109617"	"HUMAX-IL8"	"BMS-986253|HUMAX-IL-8|HUMAX-IL8|HUMAX-INFLAM|MDX-018"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2108905"	"BCG VACCINE"	"BACILLUS CALMETTE-GUERIN ANTIGEN|BACILLUS CALMETTE-GUERIN VACCINE|BCG VACCINE|BCG VACCINE, LIVE|TUBERCULOSIS VACCINE|Tice BCG"	"Unknown"	"3"	""	"2"	"19"	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1201719"	"PETROLATUM, WHITE"	"Maroline|PETROLATUM, WHITE|WHITE PETROLATUM"	"Unknown"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1762621"	"BARDOXOLONE METHYL"	"BARDOXOLONE METHYL|BARDOXOLONE METHYL ESTER|Bardoxolone Methyl|CDDO-METHYL ESTER|CDDO-Me|NSC 713200|NSC-713200|RTA 402|RTA-402"	"Small molecule"	"3"	"505.70"	"99"	"293"	"6.38"	"84.23"	"5"	"0"	"2"	"1"	"N"	"0.39"	"None"	"None"	"6.55"	"6.55"	"0"	"MOL"	"0"	"37"	"5"	"0"	"2"	"505.3192"	"NEUTRAL"	"C32H43NO4"	"COC(=O)[C@]12CCC(C)(C)C[C@H]1[C@H]1C(=O)C=C3[C@@](C)(CC[C@H]4C(C)(C)C(=O)C(C#N)=C[C@]34C)[C@]1(C)CC2"
"CHEMBL96783"	"XYLITOL"	"C-XYLIDEX CR 16055|E-967|E967|EUTRIT|FLUORETTE|INS NO.967|INS-967|KANNIT|KLINIT|KYLIT|NSC-25283|XYLITAB 300|XYLITE|XYLITE (SUGAR)|XYLITOL|XYLITOL CM 90|XYLITOL, D-|XYLITON|XYLO-PENTANE-1,2,3,4,5-PENTOL|XYLO-PENTITOL"	"Small molecule"	"3"	"152.15"	"1"	"1"	"-2.95"	"101.15"	"5"	"5"	"0"	"4"	"N"	"0.30"	"12.76"	"None"	"-3.10"	"-3.10"	"0"	"MOL"	"0"	"10"	"5"	"5"	"0"	"152.0685"	"NEUTRAL"	"C5H12O5"	"OC[C@H](O)[C@@H](O)[C@H](O)CO"
"CHEMBL2108396"	"DEFIBROTIDE"	"BOS TAURUS LUNG DEFIBROTIDE|DEFIBROTIDE|DEFIBROTIDE (BOVINE LUNG)|DEFIBROTIDE (BOVINE)"	"Oligonucleotide"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL413"	"SIROLIMUS"	"AY-22989|L04AA10|NPC-12G|NSC-226080|RAPALIMUS|RAPAMYCIN|Rapamune|SIROLIMUS|SM-88 COMPONENT SIROLIMUS|WY-090217"	"Small molecule"	"4"	"914.19"	"948"	"2648"	"6.18"	"195.43"	"13"	"3"	"3"	"6"	"N"	"0.16"	"9.96"	"None"	"7.45"	"7.45"	"0"	"MOL"	"0"	"65"	"14"	"3"	"3"	"913.5551"	"NEUTRAL"	"C51H79NO13"	"CO[C@H]1C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@H]([C@H](C)C[C@@H]2CC[C@@H](O)[C@H](OC)C2)CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)/C=C/C=C/C=C/1C"
"CHEMBL2040682"	"CICLESONIDE"	"ALVESCO|ALVESCO 160|ALVESCO 80|BI54903|CICLESONIDE|Omnaris|RPR-251526|RPR251526|ZETONNA"	"Small molecule"	"4"	"540.70"	"11"	"35"	"4.70"	"99.13"	"7"	"1"	"1"	"5"	"N"	"0.50"	"None"	"None"	"5.32"	"5.32"	"0"	"MOL"	"0"	"39"	"7"	"1"	"1"	"540.3087"	"NEUTRAL"	"C32H44O7"	"CC(C)C(=O)OCC(=O)[C@@]12O[C@H](C3CCCCC3)O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@@]12C"
"CHEMBL6966"	"VERAPAMIL"	"CP-16,533-1|CP-16533-1|CP-165331|Calan|Covera-HS|D-365|IPROVERATRIL|Isoptin|NSC-272306NA|Tarka|VERAPAMIL|VERAPAMIL SLOW RELEASE|Verapamil|Verelan"	"Small molecule"	"4"	"454.61"	"297"	"3340"	"5.09"	"63.95"	"6"	"0"	"1"	"13"	"N"	"0.42"	"None"	"9.68"	"5.04"	"2.79"	"2"	"MOL"	"0"	"33"	"6"	"0"	"1"	"454.2832"	"BASE"	"C27H38N2O4"	"COc1ccc(CCN(C)CCCC(C#N)(c2ccc(OC)c(OC)c2)C(C)C)cc1OC"
"CHEMBL1817968"	"LTX-109"	"LTX-109"	"Small molecule"	"2"	"788.10"	"7"	"30"	"3.79"	"252.91"	"6"	"11"	"2"	"18"	"N"	"0.05"	"12.53"	"12.17"	"3.67"	"-1.08"	"3"	"MOL"	"0"	"57"	"14"	"14"	"3"	"787.5585"	"BASE"	"C43H69N11O3"	"CC(C)(C)c1cc(C(C)(C)C)c2[nH]c(C(C)(C)C)c(C[C@H](NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCCc3ccccc3)c2c1"
"CHEMBL2108730"	"SARILUMAB"	"Kevzara|REG-N88|REGN-88|REGN88|SAR-153191|SAR153191|SARILUMAB|Sarilumab"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1401"	"NITAZOXANIDE"	"Alinia|NITAZOXANIDE|NSC-697855|NSC-760057|PH 5776|PH-5776"	"Small molecule"	"4"	"307.29"	"222"	"898"	"2.23"	"111.43"	"7"	"1"	"0"	"4"	"N"	"0.40"	"10.62"	"None"	"2.12"	"2.12"	"2"	"MOL"	"0"	"21"	"8"	"1"	"0"	"307.0263"	"NEUTRAL"	"C12H9N3O5S"	"CC(=O)Oc1ccccc1C(=O)Nc1ncc([N+](=O)[O-])s1"
"CHEMBL2109343"	"LERONLIMAB"	"LERONLIMAB|PRO 140|PRO-140|PRO140"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL960"	"LEFLUNOMIDE"	"Arava|HWA-486|L04AA13|LEFLUNOMIDE|LEFLUNOMIDE MEDAC|LEFLUNOMIDE RATIOPHARM|LEFLUNOMIDE TEVA|LEFLUNOMIDE WINTHROP|NSC-677411|NSC-759864|REPSO|SU-101|SU101|SULOL"	"Small molecule"	"4"	"270.21"	"185"	"1158"	"3.25"	"55.13"	"3"	"1"	"0"	"2"	"N"	"0.91"	"13.72"	"None"	"2.51"	"2.51"	"2"	"MOL"	"0"	"19"	"4"	"1"	"0"	"270.0616"	"NEUTRAL"	"C12H9F3N2O2"	"Cc1oncc1C(=O)Nc1ccc(C(F)(F)F)cc1"
"CHEMBL3039502"	"DUVELISIB"	"COPIKTRA|DUVELISIB|DUVELISIB HYDRATE|DUVELISIB MONOHYDRATE|Duvelisib|INK-1147|INK-1197|IPI-145"	"Small molecule"	"4"	"416.87"	"14"	"53"	"4.48"	"88.49"	"6"	"2"	"0"	"4"	"N"	"0.45"	"10.20"	"3.42"	"3.63"	"3.63"	"5"	"MOL"	"0"	"30"	"7"	"2"	"0"	"416.1152"	"NEUTRAL"	"C22H17ClN6O"	"C[C@H](Nc1ncnc2nc[nH]c12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1"
"CHEMBL4650447"	"RO-0622"	"AZVUDINE|RO 0622|RO-0622"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2374220"	"LEDIPASVIR"	"GS-5885|LEDIPASVIR|LEDIPASVIR ACETONATE"	"Small molecule"	"4"	"889.02"	"15"	"112"	"8.61"	"174.64"	"8"	"4"	"2"	"10"	"N"	"0.11"	"11.33"	"5.09"	"7.18"	"7.17"	"5"	"MOL"	"0"	"65"	"14"	"4"	"3"	"888.4134"	"NEUTRAL"	"C49H54F2N8O6"	"COC(=O)N[C@H](C(=O)N1CC2(CC2)C[C@H]1c1nc(-c2ccc3c(c2)C(F)(F)c2cc(-c4ccc5[nH]c([C@@H]6[C@H]7CC[C@H](C7)N6C(=O)[C@@H](NC(=O)OC)C(C)C)nc5c4)ccc2-3)c[nH]1)C(C)C"
"CHEMBL2110727"	"CENICRIVIROC"	"CENICRIVIROC|Cenicriviroc|TAK-652|TBR-652"	"Small molecule"	"3"	"696.96"	"11"	"17"	"8.74"	"85.69"	"7"	"1"	"2"	"17"	"N"	"0.11"	"13.83"	"6.39"	"7.57"	"7.54"	"4"	"MOL"	"0"	"50"	"8"	"1"	"2"	"696.3709"	"NEUTRAL"	"C41H52N4O4S"	"CCCCOCCOc1ccc(-c2ccc3c(c2)/C=C(/C(=O)Nc2ccc([S@@+]([O-])Cc4cncn4CCC)cc2)CCCN3CC(C)C)cc1"
"CHEMBL3989553"	"NAFAMOSTAT MESYLATE"	"FUT-175|NAFAMOSTAT DIMETHANESULFONATE|NAFAMOSTAT MESILATE|NAFAMOSTAT MESYLATE|RONASTAT"	"Small molecule"	"3"	"539.59"	"4"	"8"	"2.65"	"138.07"	"4"	"5"	"0"	"4"	"N"	"0.21"	"None"	"11.32"	"2.52"	"-0.28"	"3"	"MOL"	"0"	"26"	"7"	"7"	"1"	"347.1382"	"BASE"	"C21H25N5O8S2"	"CS(=O)(=O)O.CS(=O)(=O)O.N=C(N)Nc1ccc(C(=O)Oc2ccc3cc(C(=N)N)ccc3c2)cc1"
"CHEMBL4081711"	"ZIMLOVISERTIB"	"PF 06650833|PF-06650833|ZIMLOVISERTIB"	"Small molecule"	"2"	"361.37"	"34"	"104"	"1.58"	"103.54"	"5"	"2"	"0"	"6"	"N"	"0.81"	"10.59"	"2.52"	"1.05"	"1.05"	"2"	"MOL"	"0"	"26"	"7"	"3"	"0"	"361.1438"	"NEUTRAL"	"C18H20FN3O4"	"CC[C@H]1[C@@H](COc2nccc3cc(C(N)=O)c(OC)cc23)NC(=O)[C@H]1F"
"CHEMBL3833327"	"INOSINE PRANOBEX"	"DELIMMUN|IMUNOVIR|IMUNOVIRAL|INOSINE ACEDOBENE DIMEPRANOL|INOSINE PRANOBEX|INOSIPLEX|ISOPRINOSIN|ISOPRINOSINA|ISOPRINOSINE|ISOVIRAL|METHISOPRINOL|MODIMMUNAL|NP-113|NPT-10381|PRANOSINA|PRANOSINE|VIRUXAN"	"Small molecule"	"4"	"1115.25"	""	""	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"0"	"None"	"None"	"None"	"None"	"577.3799"	"None"	"C52H78N10O17"	"CC(=O)Nc1ccc(C(=O)O)cc1.CC(=O)Nc1ccc(C(=O)O)cc1.CC(=O)Nc1ccc(C(=O)O)cc1.CC(O)CN(C)C.CC(O)CN(C)C.CC(O)CN(C)C.O=c1[nH]cnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O"
"CHEMBL1200633"	"IVERMECTIN"	"22,23-DIHYDRO C-076B1|22,23-DIHYDROABAMECTIN|22,23-DIHYDROAVERMECTIN B1|22,23-DIHYDROAVERMECTIN B1A|ACAREXX|BIMECTIN|BOVINET|CARDOMEC|CARDOTEK 30|CD-5024|CD5024|CEVAMEC|Cardomec|DIHYDROAVERMECTIN B1A|EQUIMEC|EQVALAN|Eqvalan|HEARTGARD|HYVERMECTIN|Heartguard|IVECTIN|IVERMECTIN|IVERMECTIN B1A|IVERMECTIN COMPONENT B1A|IVERTIN|IVOMEC|IVOSINT|Ivomec|JETAMEC|L 640471|L-640471|MECTIZAN|MK 933|MK-933|Mectizan|NORAMECTIN|NOROMECTIN|NSC-755843|ORAMEC|PANDEX|PHOENECTIN|SKLICE|SOOLANTRA|Stromectol|UVEMEC|VERMIC|VETMEC|ZIMECTERIN"	"Unknown"	"4"	"1736.18"	"157"	"785"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"0"	"None"	"None"	"None"	"None"	"1735.0001"	"None"	"C95H146O28"	"CC[C@H](C)[C@H]1O[C@]2(CC[C@@H]1C)C[C@@H]1C[C@@H](C/C=C(\C)[C@@H](O[C@H]3C[C@H](OC)[C@@H](O[C@H]4C[C@H](OC)[C@@H](O)[C@H](C)O4)[C@H](C)O3)[C@@H](C)/C=C/C=C3\CO[C@@H]4[C@H](O)C(C)=C[C@@H](C(=O)O1)[C@]34O)O2.CO[C@H]1C[C@H](O[C@H]2[C@H](C)O[C@@H](O[C@@H]3/C(C)=C/C[C@@H]4C[C@@H](C[C@]5(CC[C@H](C)[C@@H](C(C)C)O5)O4)OC(=O)[C@@H]4C=C(C)[C@@H](O)[C@H]5OC/C(=C\C=C\[C@@H]3C)[C@@]45O)C[C@@H]2OC)O[C@@H](C)[C@@H]1O"
"CHEMBL4297717"	"CD24FC"	"CD24FC|CD24IGG1FC|EFPREZIMOD ALFA|MK-7110|SACCOVID"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4802216"	"UPANOVIMAB"	"SCTA-01|SCTA01|UPANOVIMAB"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4297957"	"AVASOPASEM MANGANESE"	"AVASOPASEM MANGANESE|AVASOPASEM MANGANESE DICHLORIDE|GC-4419|GC4419|M-40419|SC-72325A"	"Small molecule"	"3"	"483.39"	""	""	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"NONE"	"0"	"None"	"None"	"None"	"None"	"482.1650"	"None"	"C21H35Cl2MnN5"	""
"CHEMBL103"	"PROGESTERONE"	"CYCLOGEST|Crinone|Endometrin|Gesterol|LUTIGEST|MILPROSA|NSC-64377|NSC-9704|PROCHIEVE|PROGESTA-CARE|PROGESTASERT|PROGESTERONE|PROGESTERONE, MICRONIZED|PROGESTERONUM|Progesterone|Progestin|Prometrium|Regumate|SERENITY FOR WOMEN|Syngestrone|U 3672|UTROGESTAN"	"Small molecule"	"4"	"314.47"	"286"	"1479"	"4.72"	"34.14"	"2"	"0"	"0"	"1"	"N"	"0.70"	"None"	"None"	"4.15"	"4.15"	"0"	"MOL"	"0"	"23"	"2"	"0"	"0"	"314.2246"	"NEUTRAL"	"C21H30O2"	"CC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C"
"CHEMBL4650379"	"BAMLANIVIMAB"	"BAMLANIVIMAB|LY-3819253|LY-CoV555|LY3819253"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650406"	"LEVILIMAB"	"BCD-089|LEVILIMAB"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL389621"	"HYDROCORTISONE"	"ACETASOL HC|ACTICORT|AEROSEB-HC|ALA-CORT|ALA-SCALP|ALKINDI SPRINKLE|ALPHADERM|ANFLAM|ANUGESIC HC|ANUSOL HC|ANUSOL PLUS HC|ANUSOL SOOTHING RELIEF|Anucort-HC|Anusol-HC|BALNEOL-HC|BETA-HC|CALMURID HC|CANESTEN HC|CETACORT|CIPRO HC|COBADEX|COLOCORT|CORLAN|CORT-DOME|CORTENEM|CORTENEMA|CORTISOL|Cor-Oticin|Cortef|Cortifoam|Cortril|DAKTACORT|DAKTACORT HYDROCORT|DERMA CARE HYDROCORT|DERMACORT|DERMASPRAY DEMANG|DIODERM|DOME-CORT|ECONACORT|EFCORTELAN P|ELDECORT|EPICORT|EURAX-HC|EURAX-HYDROCORT|EVACORT|EXE-CORT|FLEXICORT|GERMOLOIDS HC|GLYCORT|GREGODERM|H-CORT|HC #1|HC #4|HC (HYDROCORTISONE)|HI-COR|HYDRO-RX|HYDROCORT IN CALAMINE OILY|HYDROCORT IN CETOMACROGOL FOR A|HYDROCORT IN WTE SOFT PARAF|HYDROCORTISONE|HYDROCORTISONE IN ABSORBASE|HYDRODERM|HYDRODERM HC|Hydrocortisone|Hydrocortone|Hytone|JUNGLE FOR|Locoid|MEDICORT|MILDISON LIPOCREAM|Micort-HC|NOGENIC HC|NSC-10483|NUTRACORT|NYBADEX|NYSTAFORM-HC|Neo-Cortef|OTOSEPTIL|OTOSPORIN|Ophthocort|PENECORT|PERINAL|PLENADREN|PROCTOCORT|PROCTOCREAM HC|PROCTOFOAM HC|PROCTOSEDYL|QUINOCORT|SENTIAL HC|STIE-CORT|SYNACORT|TERRA-CORTRIL NYSTATIN|TEXACORT|TIMOCORT|TIMODINE|TOPISONE|TRI-CICATRIN|Terra-Cortril|U-Cort|UNIROID|UNIROID HC|XYLOPROCT|ZENOXONE"	"Small molecule"	"4"	"362.47"	"244"	"1363"	"1.78"	"94.83"	"5"	"3"	"0"	"2"	"N"	"0.70"	"12.59"	"None"	"1.28"	"1.28"	"0"	"MOL"	"0"	"26"	"5"	"3"	"0"	"362.2093"	"NEUTRAL"	"C21H30O5"	"C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO"
"CHEMBL4594417"	"GT-0918"	"GT-0918|PROXALUTAMIDE|PRUXELUTAMIDE"	"Small molecule"	"3"	"517.51"	""	""	"5.19"	"86.26"	"6"	"0"	"2"	"6"	"N"	"0.33"	"None"	"4.73"	"4.53"	"4.52"	"3"	"MOL"	"0"	"36"	"7"	"0"	"2"	"517.1196"	"NEUTRAL"	"C24H19F4N5O2S"	"CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2F)C(=S)N1c1ccc(CCCc2ncco2)nc1"
"CHEMBL707"	"DOXAZOSIN"	"C02CA04|Cardura|DOXAZOSIN|Doxazosin|UK-33274"	"Small molecule"	"4"	"451.48"	"153"	"978"	"1.72"	"112.27"	"9"	"1"	"0"	"4"	"N"	"0.63"	"12.67"	"7.24"	"2.14"	"1.91"	"3"	"MOL"	"0"	"33"	"10"	"2"	"0"	"451.1856"	"NEUTRAL"	"C23H25N5O5"	"COc1cc2nc(N3CCN(C(=O)C4COc5ccccc5O4)CC3)nc(N)c2cc1OC"
"CHEMBL1230314"	"ESTETROL"	"15.ALPHA.-HYDROXYESTRIOL|E-4|E4|ESTETROL|ESTETROL (ANHYDROUS)|ESTETROL ANHYDROUS"	"Small molecule"	"4"	"304.39"	"4"	"8"	"1.55"	"80.92"	"4"	"4"	"0"	"0"	"N"	"0.59"	"10.33"	"None"	"1.67"	"1.67"	"1"	"MOL"	"0"	"22"	"4"	"4"	"0"	"304.1675"	"NEUTRAL"	"C18H24O4"	"C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1[C@@H](O)[C@@H](O)[C@@H]2O"
"CHEMBL313006"	"DALCETRAPIB"	"DALCETRAPIB|JTT-705|RO-4607381|RO4607381"	"Small molecule"	"3"	"389.61"	"5"	"18"	"6.68"	"46.17"	"3"	"1"	"1"	"8"	"N"	"0.50"	"13.05"	"None"	"7.92"	"7.92"	"1"	"MOL"	"0"	"27"	"3"	"1"	"1"	"389.2389"	"NEUTRAL"	"C23H35NO2S"	"CCC(CC)CC1(C(=O)Nc2ccccc2SC(=O)C(C)C)CCCCC1"
"CHEMBL1207607"	"TETRAPHENYLPORPHINE TETRASULFONIC ACID"	"NSC-322091|TETRAPHENYLPORPHINE TETRASULFONIC ACID"	"Small molecule"	"1"	"935.01"	"3"	"4"	"8.31"	"274.84"	"10"	"6"	"3"	"8"	"N"	"0.08"	"-1.71"	"4.34"	"-2.30"	"-1.56"	"7"	"MOL"	"0"	"64"	"16"	"6"	"4"	"934.0743"	"ACID"	"C44H30N4O12S4"	"O=S(=O)(O)c1ccc(-c2c3nc(c(-c4ccc(S(=O)(=O)O)cc4)c4ccc([nH]4)c(-c4ccc(S(=O)(=O)O)cc4)c4ccc([nH]4)c(-c4ccc(S(=O)(=O)O)cc4)c4nc2C=C4)C=C3)cc1"
"CHEMBL197194"	"VIDOFLUDIMUS"	"4SC-101|IMU-838|NSC-717824|SC-12267|SC12267|VIDOFLUDIMUS"	"Small molecule"	"2"	"355.37"	"5"	"18"	"4.00"	"75.63"	"3"	"2"	"0"	"5"	"N"	"0.85"	"3.07"	"None"	"3.80"	"0.33"	"2"	"MOL"	"0"	"26"	"5"	"2"	"0"	"355.1220"	"ACID"	"C20H18FNO4"	"COc1cccc(-c2ccc(NC(=O)C3=C(C(=O)O)CCC3)c(F)c2)c1"
"CHEMBL1201599"	"GLOBULIN, IMMUNE"	"BT-295|BayGam|FLEBOGAMMA|FLEBOGAMMA DIF|FLEBOGAMMADIF|GAMASTAN|GAMMAGARD LIQUID|GAMMAPLEX|GAMUNEX|GLOBULIN, IMMUNE|GLOBULIN, IMMUNE HUMAN SERUM|Gammagard|Gammagee|Gammar|Gammar-P I.V.|Gamulin|HUMAN GAMMAGLOBULIN|HUMAN IGG|HUMAN IMMUNE GLOBULIN G|HUMAN IMMUNOGLOBULIN G|HUMAN NORMAL IMMUNOGLOBULIN|IMMUNE GLOBULIN (HUMAN)|IMMUNE GLOBULIN HUMAN|IMMUNOGLOBULIN G (HUMAN)|IMMUNOGLOBULIN G, HUMAN|IMMUNOGLOBULIN HUMAN NORMAL|Immu-G|Immuglobin|KIOVIG|NEWGAM|NORMAL IMMUNOGLOBULINS|NPB-01|OCTAGAM|PRIVIGEN|Sandoglobulin|Venoglobulin-I|Venoglobulin-S"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL45"	"MELATONIN"	"5-METHOXY N-ACETYL-TRYPTAMINE|BCI-049|CIRCADIN|GENERAL NUTRIT|HEALTH AID|HEIDADOUPPI|ICENIA|J5.258B|LIFE EXT|MELAPURE|MELATOL|MELATONIN|MELATONINE|MELOVINE|Melatonin|N-(2-(5-METHOXY-1H-INDOL-3-YL)ETHYL)ACETAMIDE|N-ACETYL-5-METHOXYTRYPTAMINE|NATROL|NATURE'S BLEND|NATURES BOUNTY|NSC-113928|NSC-302012|NSC-56423|QUALITY HEALTH|REGULIN|S.GARD|TARTROL|TRAVELAG|VESPRO|VYTALONIN"	"Small molecule"	"4"	"232.28"	"244"	"1446"	"1.86"	"54.12"	"2"	"2"	"0"	"4"	"N"	"0.84"	"None"	"None"	"1.15"	"1.15"	"2"	"MOL"	"0"	"17"	"4"	"2"	"0"	"232.1212"	"NEUTRAL"	"C13H16N2O2"	"COc1ccc2[nH]cc(CCNC(C)=O)c2c1"
"CHEMBL429910"	"DAPAGLIFLOZIN"	"BMS-512148|BMS-512148-05|DAPAGLIFLOZIN|FORXIGA|LYN-045"	"Small molecule"	"4"	"408.88"	"19"	"210"	"1.84"	"99.38"	"6"	"4"	"0"	"6"	"N"	"0.58"	"12.57"	"None"	"2.11"	"2.11"	"2"	"MOL"	"0"	"28"	"6"	"4"	"0"	"408.1340"	"NEUTRAL"	"C21H25ClO6"	"CCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1"
"CHEMBL1201335"	"GLYCOPYRRONIUM"	"GLYCOPYRROLATE CATION|GLYCOPYRROLATE ION|GLYCOPYRRONIUM|GLYCOPYRRONIUM CATION|GLYCOPYRRONIUM ION|GLYCOPYRRONIUM, ERYTHRO-"	"Small molecule"	"4"	"318.44"	"11"	"24"	"2.46"	"46.53"	"3"	"1"	"0"	"4"	"N"	"0.69"	"11.53"	"None"	"-1.41"	"-1.41"	"1"	"MOL"	"0"	"23"	"4"	"1"	"0"	"318.2064"	"NEUTRAL"	"C19H28NO3+"	"C[N+]1(C)CCC(OC(=O)C(O)(c2ccccc2)C2CCCC2)C1"
"CHEMBL4650513"	"GOFLIKICEPT"	"GOFLIKICEPT|RPH 104|RPH-104"	"Protein"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1538"	"TENOFOVIR DISOPROXIL"	"(R)-BIS(POC)PMPA|BIS-POC-PMPA|GS-4331|TENOFOVIR BIS(ISOPROPYLOXYCARBONYLOXYMETHYL) ESTER|TENOFOVIR DISOPROXIL|Tenofovir disoproxil|VIREAD"	"Small molecule"	"4"	"519.45"	"15"	"27"	"3.04"	"185.44"	"15"	"1"	"2"	"13"	"N"	"0.23"	"None"	"3.74"	"2.65"	"2.65"	"2"	"MOL"	"0"	"35"	"15"	"2"	"2"	"519.1730"	"NEUTRAL"	"C19H30N5O10P"	"CC(C)OC(=O)OCOP(=O)(CO[C@H](C)Cn1cnc2c(N)ncnc21)OCOC(=O)OC(C)C"
"CHEMBL814"	"FLUVOXAMINE"	"FLUVOXAMINE|Fluvoxamine|N06AB08"	"Small molecule"	"4"	"318.34"	"48"	"163"	"3.20"	"56.84"	"4"	"1"	"0"	"9"	"N"	"0.43"	"None"	"8.86"	"2.80"	"1.33"	"1"	"MOL"	"0"	"22"	"4"	"2"	"0"	"318.1555"	"BASE"	"C15H21F3N2O2"	"COCCCC/C(=N\OCCN)c1ccc(C(F)(F)F)cc1"
"CHEMBL1230165"	"SILMITASERTIB"	"CX 4945|CX-4945|CX-4945 FREE ACID|CX4945|SILMITASERTIB|Silmitasertib"	"Small molecule"	"2"	"349.78"	"320"	"1293"	"4.88"	"75.11"	"4"	"2"	"0"	"3"	"N"	"0.52"	"3.02"	"4.61"	"3.29"	"0.94"	"4"	"MOL"	"0"	"25"	"5"	"2"	"0"	"349.0618"	"ACID"	"C19H12ClN3O2"	"O=C(O)c1ccc2c(c1)nc(Nc1cccc(Cl)c1)c1ccncc12"
"CHEMBL412531"	"THYMOSIN"	"THYMOSIN"	"Protein"	"3"	"3051.38"	"1"	"4"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"BOTH"	"0"	"None"	"None"	"None"	"None"	"3049.5013"	"None"	"C128H216N32O51S"	"CC[C@H](C)[C@@H](NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](CO)NC(=O)[C@@H](CO)NC(=O)[C@H](NC(=O)[C@@H](CC(=O)O)NC(=O)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](CC(=O)O)NC(=O)[C@@H](CO)NC(=O)[C@H](N)CS)C(C)C)C(C)C)C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](CCCCN)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](CCC(=O)O)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@H](CCC(=O)O)C(=O)O)C(C)C)C(C)C)C(C)C)[C@H](C)O"
"CHEMBL1201081"	"METHYLPREDNISOLONE SODIUM SUCCINATE"	"A-METHAPRED|METHYLPREDNISOLONE|METHYLPREDNISOLONE 21-SUCCINATE SODIUM SALT|METHYLPREDNISOLONE SODIUM SUCCINATE|MIN-I-MIX|NSC-48989|SOLU-MEDRONE|Solu-medrol|Urbasone"	"Small molecule"	"4"	"496.53"	"5"	"15"	"2.22"	"138.20"	"7"	"3"	"0"	"6"	"N"	"0.50"	"3.66"	"None"	"1.83"	"-1.50"	"0"	"MOL"	"0"	"34"	"8"	"3"	"0"	"474.2254"	"ACID"	"C26H33NaO8"	"C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(=O)COC(=O)CCC(=O)[O-])[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)C=CC(=O)C=C12.[Na+]"
"CHEMBL1450"	"ATOVAQUONE"	"566C|566C80|ATOVAQUONE|Mepron|NSC-759582|WELLVONE"	"Small molecule"	"4"	"366.84"	"48"	"459"	"5.51"	"54.37"	"3"	"1"	"1"	"2"	"N"	"0.76"	"5.73"	"None"	"5.00"	"3.33"	"2"	"MOL"	"0"	"26"	"3"	"1"	"1"	"366.1023"	"ACID"	"C22H19ClO3"	"O=C1C(O)=C([C@H]2CC[C@H](c3ccc(Cl)cc3)CC2)C(=O)c2ccccc21"
"CHEMBL1743034"	"IXEKIZUMAB"	"IXEKIZUMAB|LY-2439821|LY2439821|TALTZ"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2106323"	"LACTOSE MONOHYDRATE"	"LACTOCHEM|LACTOHALE|LACTOPRESS|LACTOPRESS GRANULATED|LACTOPRESS SPRAY DRIED|LACTOSE FASTFLO 316|LACTOSE HYDRATE|LACTOSE HYDROUS|LACTOSE MONOHYDRATE|LACTOSE, HYDROUS|LACTOSE, MONOHYDRATE|LACTOSUM, MONOHYDRATE|NSC-760401|PHARMATOSE|PHARMATOSE DCL 11|PHARMATOSE DCL II|RESPITOSE|SUPERTAB 11SD|SUPERTAB 11SD NZ|SUPERTAB 14SD|SUPERTAB 30GR|SUPERTAB 50 ODT|WYNDALE|WYNHALE"	"Small molecule"	"3"	"360.31"	""	""	"-5.40"	"189.53"	"11"	"8"	"2"	"4"	"N"	"0.24"	"11.25"	"None"	"-4.70"	"-4.70"	"0"	"MOL"	"0"	"23"	"11"	"8"	"2"	"342.1162"	"NEUTRAL"	"C12H24O12"	"O.OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O"
"CHEMBL76"	"CHLOROQUINE"	"Aralen|CHLOROCHINE|CHLOROQUINE|Chloroquine|NSC-187208"	"Small molecule"	"4"	"319.88"	"241"	"4929"	"4.81"	"28.16"	"3"	"1"	"0"	"8"	"N"	"0.76"	"None"	"10.32"	"3.93"	"0.88"	"2"	"MOL"	"0"	"22"	"3"	"1"	"0"	"319.1815"	"BASE"	"C18H26ClN3"	"CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12"
"CHEMBL1201657"	"HEPARIN SODIUM"	"CRUDE HEPARIN|CRUDE HEPARIN PORCINE|HEPARIN LOCK FLUSH|HEPARIN SODIUM|HEPARIN SODIUM PORCINE|HEPARIN SODIUM PRESERVATIVE FREE|HEPARIN SODIUM UNFRACTIONATED|HEPARIN SODIUM, PORCINE|HEPARINUM NATRICUM|LIQUAEMIN LOCK FLUSH|LIQUAEMIN SODIUM PRESERVATIVE FREE|LIQUEMIN SODIUM|Lipo-hepin|Liquaemin Sodium|MULTIPARIN|PUMP-HEP|Panheprin|S01XA14|SODIUM HEPARIN|THROMBOPHOB|UNIHEP|UNIPARIN|UNIPARIN FTE"	"Oligosaccharide"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1237022"	"TOCILIZUMAB"	"ACTEMRA|ACTEMRA ROACTEMRA|ATLIZUMAB|Actemra|BAT-1806|BAT1806|MRA|MSB-11456|MSB11456|R-1569|RG-1569|RHPM-1|RO-4877533|ROACTEMRA|TOCILIZUMAB"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL3617964"	"ALVELESTAT"	"ALVELESTAT|AZD-9668|AZD9668|MPH-966|MPH966"	"Small molecule"	"2"	"545.54"	"5"	"19"	"3.29"	"115.95"	"8"	"1"	"1"	"6"	"N"	"0.40"	"12.17"	"2.00"	"1.27"	"1.27"	"4"	"MOL"	"0"	"38"	"9"	"1"	"1"	"545.1345"	"NEUTRAL"	"C25H22F3N5O4S"	"Cc1c(-c2ccnn2C)cc(C(=O)NCc2ccc(S(C)(=O)=O)cn2)c(=O)n1-c1cccc(C(F)(F)F)c1"
"CHEMBL1269025"	"EDOXABAN"	"DU-176|EDOXABAN|LIXIANA"	"Small molecule"	"4"	"548.07"	"6"	"11"	"1.29"	"136.63"	"8"	"3"	"1"	"5"	"N"	"0.48"	"10.74"	"6.33"	"0.90"	"0.87"	"2"	"MOL"	"0"	"37"	"11"	"3"	"2"	"547.1769"	"NEUTRAL"	"C24H30ClN7O4S"	"CN1CCc2nc(C(=O)N[C@@H]3C[C@@H](C(=O)N(C)C)CC[C@@H]3NC(=O)C(=O)Nc3ccc(Cl)cn3)sc2C1"
"CHEMBL502835"	"NINTEDANIB"	"BIBF 1120|BIBF-1120|BIBF1120|INTEDANIB|NINTEDANIB|Nintedanib|OFEV|Vargatef"	"Small molecule"	"4"	"539.64"	"500"	"1019"	"3.62"	"94.22"	"7"	"2"	"1"	"7"	"N"	"0.35"	"10.86"	"7.23"	"2.79"	"2.57"	"3"	"MOL"	"0"	"40"	"9"	"2"	"1"	"539.2533"	"NEUTRAL"	"C31H33N5O4"	"COC(=O)c1ccc2c(c1)NC(=O)/C2=C(\Nc1ccc(N(C)C(=O)CN2CCN(C)CC2)cc1)c1ccccc1"
"CHEMBL4297793"	"NANGIBOTIDE"	"LR-12|MOTREM|NANGIBOTIDE"	"Protein"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1422"	"SITAGLIPTIN"	"JANUVIA|LEZ-763|LEZ763|MK-0431|SITAGLIPTIN"	"Small molecule"	"4"	"407.32"	"42"	"310"	"2.02"	"77.04"	"5"	"1"	"0"	"4"	"N"	"0.62"	"None"	"8.78"	"1.26"	"-0.14"	"2"	"MOL"	"0"	"28"	"6"	"2"	"0"	"407.1181"	"BASE"	"C16H15F6N5O"	"N[C@@H](CC(=O)N1CCn2c(nnc2C(F)(F)F)C1)Cc1cc(F)c(F)cc1F"
"CHEMBL3989977"	"EMAPALUMAB"	"EMAPALUMAB|EMAPALUMAB-LZSG|Gamifant|NI-0501"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL578"	"ENALAPRIL"	"C09AA02|ENALAPRIL|Enalapril|Lexxel|OLINAPRIL|Vaseretic|Vasotec"	"Small molecule"	"4"	"376.45"	"148"	"2327"	"1.60"	"95.94"	"5"	"2"	"0"	"9"	"N"	"0.64"	"3.67"	"5.20"	"0.59"	"-1.06"	"1"	"MOL"	"0"	"27"	"7"	"2"	"0"	"376.1998"	"ACID"	"C20H28N2O5"	"CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O"
"CHEMBL1560"	"CAPTOPRIL"	"ACEPRIL|APOPRIL|C09AA01|CAPTOMAX|CAPTOMEX|CAPTOPRIL|CAPTOPRILUM|Capoten|ECOPACE|FARCOPRIL|GARRANIL|HYPOPRESS|HYTENEZE 12.5|HYTENEZE 25|HYTENEZE 50|KAPLON|Lopril|MEPHA|NOYADA|NSC-757419|SA-333|SQ -14225|SQ 14,225|SQ-14225|TENSIOMIN|Tensobon|ZAPTO"	"Small molecule"	"4"	"217.29"	"200"	"2744"	"0.63"	"57.61"	"3"	"2"	"0"	"3"	"Y"	"0.68"	"4.02"	"None"	"0.73"	"-2.42"	"0"	"MOL"	"0"	"14"	"4"	"1"	"0"	"217.0773"	"ACID"	"C9H15NO3S"	"C[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O"
"CHEMBL79"	"LIDOCAINE"	"ALGRX 3268|ALGRX-3268|Alphacaine|Anestacon|DENTIPATCH|Embolex|Iontocaine|LIDOCAINE|LIDOCAINUM|LIGNOCAINE|LMX 4|Lidocaine|Lidocaton|Lidoderm|Lidopen|Lignocaine HCl|Lignostab|NSC-40030|ORAQIX|Octocaine|SOLARCAINE|VAGISIL|XYLESTESIN|XYLODASE|XYLOTOX|Xylocaine|ZTLIDO"	"Small molecule"	"4"	"234.34"	"201"	"1141"	"2.58"	"32.34"	"2"	"1"	"0"	"5"	"N"	"0.85"	"13.78"	"7.75"	"2.84"	"2.33"	"1"	"MOL"	"0"	"17"	"3"	"1"	"0"	"234.1732"	"NEUTRAL"	"C14H22N2O"	"CCN(CC)CC(=O)Nc1c(C)cccc1C"
"CHEMBL514800"	"APREMILAST"	"APREMILAST|CC-10004|CC10004|OTEZLA"	"Small molecule"	"4"	"460.51"	"19"	"75"	"2.43"	"119.08"	"7"	"1"	"0"	"8"	"N"	"0.60"	"12.98"	"None"	"1.31"	"1.31"	"2"	"MOL"	"0"	"32"	"9"	"1"	"0"	"460.1304"	"NEUTRAL"	"C22H24N2O7S"	"CCOc1cc([C@@H](CS(C)(=O)=O)N2C(=O)c3cccc(NC(C)=O)c3C2=O)ccc1OC"
"CHEMBL2108391"	"HONEY"	"FENG MI|FENGMI|HONEY|HONEY ABSOLUTE|REVAMIL"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2103830"	"FOSTAMATINIB"	"FOSTAMATINIB|Fostamatinib|R-788|R-788 FREE ACID|R-935788|R-935788 FREE ACID|R788 FREE ACID|R935788 FREE ACID"	"Small molecule"	"4"	"580.47"	"304"	"317"	"3.09"	"186.72"	"12"	"4"	"2"	"10"	"N"	"0.26"	"1.44"	"2.71"	"1.46"	"-0.52"	"3"	"MOL"	"0"	"40"	"15"	"4"	"2"	"580.1483"	"ACID"	"C23H26FN6O9P"	"COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)N(COP(=O)(O)O)C(=O)C(C)(C)O4)n2)cc(OC)c1OC"
"CHEMBL3137301"	"SACUBITRIL"	"AHU-377|AHU377|SACUBITRIL"	"Small molecule"	"4"	"411.50"	"3"	"8"	"3.84"	"92.70"	"4"	"2"	"0"	"11"	"N"	"0.55"	"4.18"	"None"	"3.79"	"0.74"	"2"	"MOL"	"0"	"30"	"6"	"2"	"0"	"411.2046"	"ACID"	"C24H29NO5"	"CCOC(=O)[C@H](C)C[C@@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)CCC(=O)O"
"CHEMBL1201476"	"ENOXAPARIN SODIUM"	"CLEXANE|ENOXAPARIN|ENOXAPARIN SODIUM|ENOXAPARIN SODIUM (PRESERVATIVE FREE)|ENOXAPARIN SODIUM SALT|KLEXANE|LOVENOX (PRESERVATIVE FREE)|Lovenox|PK 10169|PK-10169|RP 54563|RP-54563"	"Oligosaccharide"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL41"	"FLUOXETINE"	"FLUOXETIN RATIOPHARM|FLUOXETINE|FLUVAL|Fluoxetine|NSC-283480|NSC-758685|Prozac|Sarafem|Symbyax"	"Small molecule"	"4"	"309.33"	"225"	"1215"	"4.44"	"21.26"	"2"	"1"	"0"	"6"	"N"	"0.85"	"None"	"9.80"	"4.17"	"1.83"	"2"	"MOL"	"0"	"22"	"2"	"1"	"0"	"309.1340"	"BASE"	"C17H18F3NO"	"CNCCC(Oc1ccc(C(F)(F)F)cc1)c1ccccc1"
"CHEMBL1042"	"CHOLECALCIFEROL"	"7-DEHYDROCHOLESTEROL, ACTIVATED|ACCRETE D3|ACIFEROL D3|ADCAL-D3|AK R215 COMPONENT COLECALCIFEROL|AK-R215 COMPONENT COLECALCIFEROL|AVITICOL|BIO-VITAMIN D3|BIOLIFE VITAMIN D3|CACIT D3|CALCEOS|CALCI-D|CALCICHEW D3|CALCICHEW D3 FTE|CALCICHEW D3 ONCE DAILY|CALDRINK D3|CALFOVIT D3|CHOLECALCIFEROL|COLECAL D3|COLECALCIFEROL|COLECALCIFEROLUM|COLEKAL-D3|COLEVIT D3|CUBICOLE D3|Cholecalciferol|Colecalciferol|D-MAX|D-TRACETTEN|D-VIT3|D3 LEMON MELTS|D3-50|DEKRISTOL|DELSTEROL|DELTA-D|DEPARAL|DESUNIN|DLUX 400|Dihydrocholesterol|E-D3|EBIVIT|EVACAL D3|FULTIUM DAILY D3|FULTIUM-D3|HUX D3|INVITA D3|ISO D3|KORA LIQUID|NATECAL D3|NATURE'S REMEDY VITAMIN D3|NEO-D|NPHD3|NSC-375571|OSTEOCAPS D3|PLENACHOL|PRO D3|PRO D3 FOLIC|PRO D3 FORTE|PROVITINA|RICKETON|ROYALVIT D3|STEXEROL-D3|STIVIT-D3|SUNVIT-D3 1,000|SUNVIT-D3 10,000|SUNVIT-D3 2,000|SUNVIT-D3 20,000|SUNVIT-D3 3,000|SUNVIT-D3 400|SUNVIT-D3 5,000|SUNVIT-D3 50,000|SUNVIT-D3 800|SYNERVIT-D3|THEICAL D-3|THORENS|VIGANTOL|VIGANTOLETTEN|VIGANTOLETTEN 500|VIT D3 STREULI|VITA-D3|VITAMIN D|VITAMIN D (CHOLECALCIFEROL)|VITAMIN D ASSAY SYSTEM SUITABILITY|VITAMIN D-3|VITAMIN D3|VITAMIN D3 (AS CHOLECALCIFEROL)|Vitamin D 3|ZYMAD"	"Small molecule"	"4"	"384.65"	"158"	"783"	"7.62"	"20.23"	"1"	"1"	"1"	"6"	"N"	"0.50"	"None"	"None"	"7.13"	"7.13"	"0"	"MOL"	"0"	"28"	"1"	"1"	"1"	"384.3392"	"NEUTRAL"	"C27H44O"	"C=C1CC[C@H](O)C/C1=C/C=C1\CCC[C@@]2(C)[C@H]1CC[C@@H]2[C@H](C)CCCC(C)C"
"CHEMBL3545189"	"LANADELUMAB"	"DX-2930|LANADELUMAB|LANADELUMAB (SHP643)|LANADELUMAB-FLYO|SHP-643|TAK-743|Takhzyro"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650320"	"MOLNUPIRAVIR"	"EIDD 1931-ISOPROPYL ESTER|EIDD-2801|MK-4482|MOLNUPIRAVIR"	"Small molecule"	"3"	"329.31"	"1"	"4"	"-1.72"	"146.37"	"9"	"4"	"0"	"4"	"N"	"0.29"	"8.21"	"None"	"-0.36"	"-0.42"	"1"	"MOL"	"0"	"23"	"10"	"4"	"0"	"329.1223"	"NEUTRAL"	"C13H19N3O7"	"CC(C)C(=O)OC[C@H]1O[C@@H](n2cc/c(=N\O)[nH]c2=O)[C@H](O)[C@@H]1O"
"CHEMBL4650462"	"REGDANVIMAB"	"CT-P59|REGDANVIMAB"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL237500"	"LINAGLIPTIN"	"BI 1356|BI 1356 BS|BI-1356|BI-1356-BS|BI-1356BS|BS 1356 BS|BS-1356-BS|LINAGLIPTIN|TRADJENTA|TRAJENTA|TRAZENTA"	"Small molecule"	"4"	"472.55"	"37"	"175"	"1.15"	"116.86"	"10"	"1"	"0"	"4"	"N"	"0.44"	"None"	"9.86"	"2.80"	"0.41"	"4"	"MOL"	"0"	"35"	"10"	"2"	"0"	"472.2335"	"BASE"	"C25H28N8O2"	"CC#CCn1c(N2CCC[C@@H](N)C2)nc2c1c(=O)n(Cc1nc(C)c3ccccc3n1)c(=O)n2C"
"CHEMBL1743039"	"MAVRILIMUMAB"	"CAM-3001|CAM3001|KPL-301|MAVRILIMUMAB"	"Antibody"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1236524"	"GALIDESIVIR"	"BCX-4430|BCX4430|GALIDESIVIR|IMMUCILLIN A"	"Small molecule"	"1"	"265.27"	"7"	"15"	"-1.73"	"140.31"	"7"	"6"	"1"	"2"	"N"	"0.38"	"12.95"	"8.46"	"-2.14"	"-3.24"	"2"	"MOL"	"0"	"19"	"8"	"7"	"1"	"265.1175"	"NEUTRAL"	"C11H15N5O3"	"Nc1ncnc2c([C@@H]3N[C@H](CO)[C@@H](O)[C@H]3O)c[nH]c12"
"CHEMBL1421"	"DASATINIB"	"BMS-354825|BMS-354825 HYDRATE|BMS-354825-03|DASATINIB|DASATINIB ANHYDROUS|DASATINIB HYDRATE|DASATINIB MONOHYDRATE|NSC-759877|Sprycel"	"Small molecule"	"4"	"488.02"	"946"	"2387"	"3.31"	"106.51"	"9"	"3"	"0"	"7"	"N"	"0.47"	"8.52"	"7.19"	"3.83"	"3.74"	"3"	"MOL"	"0"	"33"	"9"	"3"	"0"	"487.1557"	"NEUTRAL"	"C22H26ClN7O2S"	"Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCO)CC2)n1"
"CHEMBL1655"	"TOREMIFENE"	"ACAPODENE|CHLORTAMOXIFEN|FARESTONE|GTX-006|J33.157K|TOREMIFENE|TOREMIPHENE|Toremifene"	"Small molecule"	"4"	"405.97"	"28"	"111"	"6.22"	"12.47"	"2"	"0"	"1"	"9"	"N"	"0.31"	"None"	"8.76"	"6.27"	"4.89"	"3"	"MOL"	"0"	"29"	"2"	"0"	"1"	"405.1859"	"BASE"	"C26H28ClNO"	"CN(C)CCOc1ccc(/C(=C(/CCCl)c2ccccc2)c2ccccc2)cc1"
"CHEMBL2"	"PRAZOSIN"	"CP-12299|CP-122991|PRAZOSIN|Prazosin"	"Small molecule"	"4"	"383.41"	"205"	"1643"	"1.78"	"106.95"	"8"	"1"	"0"	"4"	"N"	"0.73"	"None"	"7.24"	"1.65"	"1.43"	"3"	"MOL"	"0"	"28"	"9"	"2"	"0"	"383.1594"	"NEUTRAL"	"C19H21N5O4"	"COc1cc2nc(N3CCN(C(=O)c4ccco4)CC3)nc(N)c2cc1OC"
"CHEMBL1201498"	"AMINO ACIDS"	".ALPHA.-AMINO ACIDS|AMINESS|AMINO ACIDS|AMINO ACIDS 11.4%|AMINO ACIDS 15%|AMINO ACIDS 20%|AMINO ACIDS 4%|AMINO ACIDS 5%|AMINO ACIDS 5.4%|AMINO ACIDS 6%|AMINO ACIDS 6.5%|AMINO ACIDS 6.9%|AMINO ACIDS 8%|AMINO ACIDS NOS|AMINO ACIDS, SOURCE UNSPECIFIED|AMINOSYN|AMINOSYN II|AMINOSYN-HBC|AMINOSYN-HF|AMINOSYN-PF|AMINOSYN-RF|Amino acids|BRANCHAMIN|FREAMINE|FREAMINE HBC|FREAMINE II|FREAMINE III|HEPATAMINE|HEPATASOL|L-.ALPHA.-AMINO ACIDS|L-AMINO ACIDS|NEOPHAM|NEPHRAMINE|NOVAMINE|RENAMIN W/O ELECTROLYTES|TRAVASOL|TROPHAMINE"	"Unknown"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL3544909"	"CALCIFEDIOL"	"CALCIDIOL|CALCIFEDIOL|CALCIFEDIOL HYDRATE|CTAP-101|CTAP101|Calderol|DIDROGYL|HIDROFEROL|RAYALDEE|RAYALDY|U-32,070E|U-32070E"	"Small molecule"	"4"	"418.66"	"3"	"5"	"6.73"	"40.46"	"2"	"2"	"1"	"6"	"N"	"0.52"	"None"	"None"	"5.65"	"5.65"	"0"	"MOL"	"0"	"29"	"2"	"2"	"1"	"400.3341"	"NEUTRAL"	"C27H46O3"	"C=C1CC[C@H](O)C/C1=C/C=C1\CCC[C@@]2(C)[C@H]1CC[C@@H]2[C@H](C)CCCC(C)(C)O.O"
"CHEMBL197672"	"EMRICASAN"	"EMRICASAN|IDN 6556|IDN-6556|PF 03491390|PF-03491390|VAY-785|VAY785"	"Small molecule"	"2"	"569.51"	"23"	"38"	"2.59"	"150.90"	"6"	"4"	"1"	"10"	"N"	"0.20"	"3.51"	"None"	"3.42"	"0.05"	"2"	"MOL"	"0"	"40"	"10"	"4"	"1"	"569.1785"	"ACID"	"C26H27F4N3O7"	"C[C@H](NC(=O)C(=O)Nc1ccccc1C(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)COc1c(F)c(F)cc(F)c1F"
"CHEMBL131"	"PREDNISOLONE"	"CORTALONE|DEKOTIL|DELTACORTRIL|DELTALONE|DILACORT|Delta-cortef|Desowen|FERNISOLONE-P|Hydeltra|Hydeltra-Tba|Meti-derm|Meticortelone|NSC-9120|NSC-9900|Neo-Delta-Cortef|PEVANTI|PRECORTISYL|PRECORTISYL FTE|PREDNISOLONE|PRELONE|Poly-Pred|Pred-G|Prednisolone|SCHERIPROCT|Servisone|Sterane|Tridesilon|Verdeso"	"Small molecule"	"4"	"360.45"	"172"	"1443"	"1.56"	"94.83"	"5"	"3"	"0"	"2"	"N"	"0.69"	"12.59"	"None"	"1.27"	"1.27"	"0"	"MOL"	"0"	"26"	"5"	"3"	"0"	"360.1937"	"NEUTRAL"	"C21H28O5"	"C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO"
"CHEMBL2108738"	"NIVOLUMAB"	"BMS-936558|BMS-986298|MDX-1106|NIVOLUMAB|ONO-4538|OPDIVO"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650372"	"AG0302-COVID19"	"AG0302-COVID19|PVAX1-SARS-COV2"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL529"	"AZITHROMYCIN"	"ANHYDROUS AZITHROMYCIN|ARUZILINA|AZIROMYCIN|AZITHROCIN|AZITHROMYCIN|AZITHROMYCIN (AS DIHYDRATE)|AZITHROMYCIN ANHYDROUS|AZITHROMYCIN DIHYDRATE|AZITHROMYCIN HYDRATE|AZITHROMYCIN, UNSPECIFIED|AZITHROMYCIN, UNSPECIFIED FORM|AZIWIN|AZYTER|Azasite|CLAMELLE|CP 62993|CP-62,993|CP-62993|DURASITE|HEMOMYCIN|MACROZIT|NSC-758625|SUMAMED|Sumamed|Sunamed|TROZOCINA|XITHRONE|XZ 405|XZ 450|XZ-450|ZITHROMAC|ZMax|ZYTHROMAX|Zithromax"	"Small molecule"	"4"	"749.00"	"251"	"3418"	"1.90"	"180.08"	"14"	"5"	"2"	"7"	"N"	"0.24"	"12.43"	"9.57"	"2.44"	"-1.23"	"0"	"MOL"	"0"	"52"	"14"	"5"	"2"	"748.5085"	"BASE"	"C38H72N2O12"	"CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@]1(C)O"
"CHEMBL4297333"	"VB-201"	"VB 201|VB-201"	"Small molecule"	"2"	"581.77"	""	""	"6.33"	"114.35"	"7"	"1"	"2"	"30"	"N"	"0.06"	"1.85"	"None"	"2.66"	"1.77"	"0"	"MOL"	"0"	"39"	"9"	"1"	"2"	"581.4057"	"ACID"	"C29H60NO8P"	"CCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OCCCCC(=O)O"
"CHEMBL1201823"	"ABATACEPT"	"ABATACEPT|ABATACEPT (GENETICAL RECOMBINATION)|ABATACEPT RECOMBINANT|BMS-188667|CTLA4-IGG4M|ORENCIA|ORENCIA CLICKJECT|RG-1046|RG-2077"	"Protein"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL196"	"ASCORBIC ACID"	"3-KETO-L-GULOFURANOLACTONE|ACIDUM ASCORBICUM|ASCOLTIN|ASCOR|ASCORBATE|ASCORBIC ACID|ASCORBIC ACID (VIT C)|ASCORBIC ACID, L-|ASCORBICUM ACIDUM|ASCUR|Ascorbic Acid|Ascorbicap|BASSETT'S|CEVITAMIC ACID|Cebione|Cecon|Cenolate|Cetane|Cetane-Caps TC|Cevalin|Cevex|E-300|E300|FEMA NO. 2109|HALIBORANGE|INS NO.300|INS-300|L-ASCORBATE|L-ASCORBIC ACID|NSC-218455|NSC-33832|REDOXON|REDOXON C|REDOXON CHEW-C|REDOXON SLOW RELEASE|TOP C|VITAL LIFE|VITAMIN C|VITAMIN C (AS ASCORBIC ACID)|Vitamin C"	"Small molecule"	"4"	"176.12"	"200"	"1681"	"-1.41"	"107.22"	"6"	"4"	"0"	"2"	"N"	"0.39"	"4.36"	"None"	"-1.91"	"-4.83"	"0"	"MOL"	"0"	"12"	"6"	"4"	"0"	"176.0321"	"ACID"	"C6H8O6"	"O=C1O[C@H]([C@@H](O)CO)C(O)=C1O"
"CHEMBL660"	"AMANTADINE"	"AMANTADINE|AMANTIDINE|Amantadine|NSC-341865|Symadine|Symmetrel|TCMDC-125869"	"Small molecule"	"4"	"151.25"	"180"	"1377"	"1.91"	"26.02"	"1"	"1"	"0"	"0"	"Y"	"0.56"	"None"	"10.71"	"1.47"	"-1.38"	"0"	"MOL"	"0"	"11"	"1"	"2"	"0"	"151.1361"	"BASE"	"C10H17N"	"NC12CC3CC(CC(C3)C1)C2"
"CHEMBL393220"	"ATORVASTATIN CALCIUM"	"ATORVASTATIN CALCIUM|ATORVASTATIN CALCIUM (ANHYDROUS)|ATORVASTATIN CALCIUM ANHYDROUS|ATORVASTATIN CALCIUM HYDRATE|ATORVASTATIN CALCIUM SALT ANHYDROUS|ATORVASTATIN CALCIUM SALT TRIHYDRATE|ATORVASTATIN CALCIUM TRIHYDRATE|CI-981|Lipitor|NSC-758617"	"Small molecule"	"4"	"1155.36"	"25"	"89"	"6.31"	"111.79"	"5"	"4"	"2"	"12"	"N"	"0.16"	"4.31"	"None"	"5.39"	"2.43"	"4"	"MOL"	"0"	"41"	"7"	"4"	"2"	"558.2530"	"ACID"	"C66H68CaF2N4O10"	"CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)[O-].CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)[O-].[Ca+2]"
"CHEMBL6"	"INDOMETHACIN"	"ACONIP|ARTRACIN|ARTRACIN SR|BERLIND 75 RET|DURAMETACIN|FLEXIN-25 CONTINUS|FLEXIN-50 CONTINUS|FLEXIN-75 CONTINUS|IMBRILON|INDO-LEMMON|INDO-PAED|INDOCID RET|INDOCID-R|INDOCIN SR|INDODERM|INDOFLEX|INDOLAR|INDOLAR SR|INDOMAX-25|INDOMAX-75 SR|INDOMETACIN|INDOMETACIN FARNESIL|INDOMETACINUM|INDOMETHACIN|INDOMOD|INDOPTOL|INDOTARD MR 75|Indocin|LEDMECIN|MAXIMET SR|MOBILAN|NSC-757061|NSC-77541|PARDELPRIN MR|REUMACIDE|RHEUMACIN LA|RIMACID|SLO-INDO|TIVORBEX"	"Small molecule"	"4"	"357.79"	"329"	"7126"	"3.93"	"68.53"	"4"	"1"	"0"	"4"	"N"	"0.77"	"3.79"	"None"	"3.53"	"0.26"	"3"	"MOL"	"0"	"25"	"5"	"1"	"0"	"357.0768"	"ACID"	"C19H16ClNO4"	"COc1ccc2c(c1)c(CC(=O)O)c(C)n2C(=O)c1ccc(Cl)cc1"
"CHEMBL773"	"GLYCINE"	"AMINOACETIC ACID|FEMA NO. 3287|GLYCINE|GLYCOCOLL|Glycine|Glycolixir|NSC-25936"	"Small molecule"	"4"	"75.07"	"137"	"584"	"-0.97"	"63.32"	"2"	"2"	"0"	"1"	"N"	"0.42"	"2.31"	"9.24"	"-3.41"	"-3.42"	"0"	"MOL"	"0"	"5"	"3"	"3"	"0"	"75.0320"	"ZWITTERION"	"C2H5NO2"	"NCC(=O)O"
"CHEMBL1111"	"AMBRISENTAN"	"AMBRISENTAN|Ambrisentan|GSK-1325760|GSK-1325760A|GSK1325760|GSK1325760A|LU-208075|Letairis|VOLIBRIS"	"Small molecule"	"4"	"378.43"	"20"	"71"	"3.52"	"81.54"	"5"	"1"	"0"	"7"	"N"	"0.68"	"3.08"	"4.00"	"2.97"	"0.40"	"3"	"MOL"	"0"	"28"	"6"	"1"	"0"	"378.1580"	"ACID"	"C22H22N2O4"	"COC(c1ccccc1)(c1ccccc1)[C@H](Oc1nc(C)cc(C)n1)C(=O)O"
"CHEMBL38434"	"BREQUINAR"	"BREQUINAR"	"Small molecule"	"2"	"375.37"	"91"	"232"	"5.85"	"50.19"	"2"	"1"	"1"	"3"	"N"	"0.49"	"3.38"	"0.75"	"6.27"	"2.86"	"4"	"MOL"	"0"	"28"	"3"	"1"	"1"	"375.1071"	"ACID"	"C23H15F2NO2"	"Cc1c(-c2ccc(-c3ccccc3F)cc2)nc2ccc(F)cc2c1C(=O)O"
"CHEMBL964"	"DISULFIRAM"	"Antabuse|DISULFIRAM|Disulfiram|ESPERAL|NSC-25953|ORA-102|ORA102"	"Small molecule"	"4"	"296.55"	"265"	"2629"	"3.62"	"6.48"	"4"	"0"	"0"	"4"	"N"	"0.57"	"None"	"None"	"4.16"	"4.16"	"0"	"MOL"	"0"	"16"	"2"	"0"	"0"	"296.0509"	"None"	"C10H20N2S4"	"CCN(CC)C(=S)SSC(=S)N(CC)CC"
"CHEMBL1753"	"CLINDAMYCIN"	"7(S)-CHLORO-7-DEOXYLINCOMYCIN|Antirobe|CHLORODEOXYLINCOMYCIN|CHLOROLINCOMYCIN|CLINDAMYCIN|Cleocin|Cleocin T|Clindamycin|Sobelin|U-21,251|U-21251"	"Small molecule"	"4"	"424.99"	"283"	"3605"	"0.39"	"102.26"	"7"	"4"	"0"	"7"	"N"	"0.44"	"12.41"	"7.55"	"1.04"	"0.65"	"0"	"MOL"	"0"	"27"	"7"	"4"	"0"	"424.1799"	"NEUTRAL"	"C18H33ClN2O5S"	"CCC[C@@H]1C[C@@H](C(=O)N[C@H]([C@H](C)Cl)[C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)N(C)C1"
"CHEMBL1201580"	"ADALIMUMAB"	"ABP-501|ABRILADA|ADALIMUMAB|ADALIMUMAB (GENETICAL RECOMBINATION)|ADALIMUMAB (HUMIRA)|ADALIMUMAB BETA|ADALIMUMAB BIOSIMILAR (ALVOTECH)|ADALIMUMAB BIOSIMILAR (AVT02)|ADALIMUMAB BIOSIMILAR (CT-P17)|ADALIMUMAB BIOSIMILAR (FKB-327)|ADALIMUMAB BIOSIMILAR (ZRC-3197)|ADALIMUMAB-ADAZ|ADALIMUMAB-ADBM|ADALIMUMAB-AFZB|ADALIMUMAB-ATTO|ADALIMUMAB-BWWD|ADALIMUMAB-FKJP|AMJEVITA|AVT-02|AVT02|BCD-057|BI-695501|BI695501|CHS-1420|CT-P17|CYLTEZO|D2E7|EXEMPTIA|FKB-327|FKB327|GP-2017|GP2017|HADLIMA|HLX-03|HLX03|HULIO|HUMIRA|HYRIMOZ|LU-200134|LU200134|M-923|M923|MSB-11022|MSB11022|ONS-3010|TRUDEXA|ZRC-3197|ZRC3197"	"Antibody"	"4"	""	"2"	"19"	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL547"	"ISOTRETINOIN"	"13 Cis-Retinoic Acid|13-CIS-RETINOIC ACID|ABSORICA|ABSORICA LD|Accutane|Amnesteem|Claravis|ISOTRETINOIN|ISOTREX|MYORISAN|NSC-758156|PAT-001|RETINOIC ACID 13-CIS-FORM|RETINOIC ACID, 13-CIS-|RO 4-3780|RO-4-3780|RO-43780|ROACCUTANE|Sotret|VITAMIN A ACID, 13-CIS|ZENATANE"	"Small molecule"	"4"	"300.44"	"181"	"937"	"5.60"	"37.30"	"1"	"1"	"1"	"5"	"N"	"0.53"	"4.76"	"None"	"5.01"	"2.42"	"0"	"MOL"	"0"	"22"	"2"	"1"	"1"	"300.2089"	"ACID"	"C20H28O2"	"CC1=C(/C=C/C(C)=C/C=C/C(C)=C\C(=O)O)C(C)(C)CCC1"
"CHEMBL19019"	"NALTREXONE"	"Celupan|EN-1639A|EN-1639A FREE BASE|EN-1639A [AS HYDROCHLORIDE]|NALTREXONE|NSC-758439|Revia|Trexal|Trexan|Vivitrol"	"Small molecule"	"4"	"341.41"	"149"	"983"	"1.53"	"70.00"	"5"	"2"	"0"	"2"	"N"	"0.85"	"10.11"	"8.88"	"1.36"	"0.13"	"1"	"MOL"	"0"	"25"	"5"	"2"	"0"	"341.1627"	"BASE"	"C20H23NO4"	"O=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5"
"CHEMBL269732"	"TACROLIMUS"	"FK-506|FK506|FR-900506|NSC-758659|Prograf|Protopic|TACROLIMUS|TACROLIMUS MONOHYDRATE"	"Small molecule"	"4"	"804.03"	"166"	"968"	"4.64"	"178.36"	"12"	"3"	"2"	"7"	"N"	"0.18"	"9.96"	"None"	"5.59"	"5.59"	"0"	"MOL"	"0"	"57"	"13"	"3"	"2"	"803.4820"	"NEUTRAL"	"C44H69NO12"	"C=CC[C@@H]1/C=C(\C)C[C@H](C)C[C@H](OC)[C@H]2O[C@@](O)(C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@H](/C(C)=C/[C@@H]3CC[C@@H](O)[C@H](OC)C3)[C@H](C)[C@@H](O)CC1=O)[C@H](C)C[C@@H]2OC"
"CHEMBL2003538"	"CETYLPYRIDINIUM CHLORIDE"	"CETYLPYRIDINIUM CHLORIDE|CETYLPYRIDINIUM CHLORIDE HYDRATE|CETYLPYRIDINIUM CHLORIDE MONOHYDRATE|Ceepryn|Cepacol|GPPE DENTAL RINSE|GPPE ORAL LIQ|MEROCET|MEROCETS|MEROCETS PLUS|MEROVIT|NB-002|NSC-14864|NSC-756673|SEARCH|STERADENT"	"Small molecule"	"4"	"358.01"	"14"	"26"	"6.46"	"3.88"	"0"	"0"	"1"	"15"	"N"	"0.26"	"None"	"None"	"3.47"	"3.47"	"1"	"MOL"	"0"	"22"	"1"	"0"	"1"	"304.2999"	"NEUTRAL"	"C21H40ClNO"	"CCCCCCCCCCCCCCCC[n+]1ccccc1.O.[Cl-]"
"CHEMBL1201834"	"CANAKINUMAB"	"ACZ-885|ACZ885|CANAKINUMAB|ILARIS"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1201622"	"PORACTANT ALFA"	"CHF-6440 COMPONENT PORACTANT ALFA|Curosurf|PORACTANT ALFA|Poractant Alfa"	"Unknown"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1409"	"FLUVOXAMINE MALEATE"	"DU-23000|DU23000|FAVERIN|FAVERIN 100|FAVERIN 50|FEVARIN|FLOXYFRAL|FLUVOXAMINE HYDROGENMALEATE|FLUVOXAMINE MALEATE|LUVOX CR|Luvox|NSC-759602"	"Small molecule"	"4"	"434.41"	"46"	"120"	"3.20"	"56.84"	"4"	"1"	"0"	"9"	"N"	"0.43"	"None"	"8.86"	"2.80"	"1.33"	"1"	"MOL"	"0"	"22"	"4"	"2"	"0"	"318.1555"	"BASE"	"C19H25F3N2O6"	"COCCCC/C(=N\OCCN)c1ccc(C(F)(F)F)cc1.O=C(O)/C=C\C(=O)O"
"CHEMBL3900409"	"BRENSOCATIB"	"AZD 7986|AZD-7986|AZD7986|BRENSOCATIB|INS-1007|INS1007"	"Small molecule"	"3"	"420.47"	"20"	"71"	"1.73"	"109.29"	"7"	"2"	"0"	"5"	"N"	"0.65"	"11.64"	"8.97"	"1.39"	"-0.19"	"3"	"MOL"	"0"	"31"	"8"	"2"	"0"	"420.1798"	"BASE"	"C23H24N4O4"	"Cn1c(=O)oc2ccc(-c3ccc(C[C@@H](C#N)NC(=O)[C@@H]4CNCCCO4)cc3)cc21"
"CHEMBL58510"	"CHLOROQUINE PHOSPHATE"	"ARECHIN|AVLOCLOR|Aralen|CHLOROQUINE DIPHOSPHATE|CHLOROQUINE PHOSPHATE|CHLOROQUINI PHOSPHAS|Chloroquine Diphosphate|Chloroquine Phosphate|MALAQUIN|MALARIVON|NSC-14050|RESOCHIN|SN-7618|WR-1522"	"Small molecule"	"4"	"515.87"	"49"	"325"	"4.81"	"28.16"	"3"	"1"	"0"	"8"	"N"	"0.76"	"None"	"10.32"	"3.93"	"0.88"	"2"	"MOL"	"0"	"22"	"3"	"1"	"0"	"319.1815"	"BASE"	"C18H32ClN3O8P2"	"CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12.O=P(O)(O)O.O=P(O)(O)O"
"CHEMBL1200574"	"SODIUM CHLORIDE"	"0.9% NACL|0.9% SALINE|0.9% SALINE SOLUTION|10% SODIUM CHLORIDE INJECTION|AQSIA (BALANCED SALT SOLN)|ASKINA|ASKINA JET|B1655|BALANCED SALT|BRONCHO SALINE|BSS (BALANCED SALT SOLN)|FLOWFUSOR|FRESENIUS|HYPROMELLOSE IN RINGERS SOLN|IOCARE (BALANCED SALT SOLN)|IRRICLENS|ISOT SALINE|ISOTONIC|ISOTONIC SALINE|LABMIST|LOCKES|LS-1700|MACOPERF|MINIVERSOL|MURO 128|NACL 0.9%|NINE LIVES|NORMAL SALINE|NORMASOL|NSC-77364|OFT CUSI ANTIEDEMA|OPTIFLO S|PHYSIOMER|RINGER'S|RINGER-LOCKE|RNS-60 COMPONENT SALINE|RNS60 COMPONENT SALINE|S-CHLOR SF|SALEX|SALINE|SALINE SOLUTION|SALINE STERIPOULE|SALINEX|SEA WATER|SLOW SOD|SODICLOR|SODIUM CHLORIDE|SODIUM CHLORIDE 14.6%|SODIUM CHLORIDE 23.4%|SODIUM CHLORIDE SOLUTION|SODIUM CHLORIDE, HYPERTONIC|STERAC|STERI-WASH|STERIJET|SYRISAL|Sodium Chloride, Hypertonic|TOPICLENS|TUBILUX|Table Salt|URIFLEX-S|URIFLEX-SP|UROCLENS|VITACLEAN"	"Small molecule"	"4"	"58.44"	"15"	"136"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"MOL"	"1"	"None"	"None"	"None"	"None"	"57.9586"	"None"	"ClNa"	"[Cl-].[Na+]"
"CHEMBL395429"	"OXYTOCIN"	"ALPHA-HYPOPHAMINE|ENDOPITUITRINA|INTERTOCINE S|OXYTOCIN|OXYTOCINUM|Orasthin|Pitocin|SYNTOMETRINE|Syntocinon|TNX-1900|TNX1900|TTA-121"	"Protein"	"4"	"1007.21"	"37"	"276"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"BOTH"	"0"	"None"	"None"	"None"	"None"	"1006.4365"	"None"	"C43H66N12O12S2"	"CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O"
"CHEMBL4594592"	"REGN-3048"	"REGN-3048|REGN3048"	"Unknown"	"1"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1200694"	"SEVOFLURANE"	"MR-6S4|MR6S4|NSC-760367|SEVOCALM|SEVOFLO|SEVOFLURANE|SEVORANE|SOJOURN|Ultane"	"Small molecule"	"4"	"200.05"	"5"	"59"	"2.42"	"9.23"	"1"	"0"	"0"	"2"	"Y"	"0.62"	"None"	"None"	"2.27"	"2.27"	"0"	"MOL"	"0"	"12"	"1"	"0"	"0"	"200.0072"	"NEUTRAL"	"C4H3F7O"	"FCOC(C(F)(F)F)C(F)(F)F"
"CHEMBL454801"	"UBIDECARENONE"	"ADELIR|API 31510|API-31510|AQUA Q10|BIO-QUINONE Q10|BPM-31510|BPM31510|CO-ENZYME Q10|COENZYME Q-10|COENZYME Q-199|COENZYME Q10|COQ10|NSC-140665|NSC-140865|ORISTAR UBQ|PURESORB Q 40|UBIDECARENONE|UBIDECARENONE FOR SYSTEM SUITABILITY|UBIQUINONE|UBIQUINONE 10|UBIQUINONE 50|UBIQUINONE Q10|UBIQUINONE-10|UNISPHERES Q 10|VITAMIN Q"	"Small molecule"	"3"	"863.36"	"21"	"36"	"17.85"	"52.60"	"4"	"0"	"2"	"31"	"N"	"0.05"	"None"	"None"	"17.16"	"17.16"	"0"	"MOL"	"0"	"63"	"4"	"0"	"2"	"862.6839"	"NEUTRAL"	"C59H90O4"	"COC1=C(OC)C(=O)C(C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)=C(C)C1=O"
"CHEMBL2108350"	"CONESTAT ALFA"	"C1 ESTERASE INHIBITOR|COMPLEMENT C1 ESTERASE INHIBITOR|CONESTAT ALFA|RECOMBINANT HUMAN C1 INHIBITOR|RECOMBINANT HUMAN C1-INHIBITOR|RHUCIN|RUCONEST"	"Protein"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4303782"	"ZOTATIFIN"	"EFT-226|EFT226|ZOTATIFIN"	"Small molecule"	"1"	"487.56"	"7"	"67"	"2.78"	"108.07"	"8"	"2"	"0"	"6"	"N"	"0.55"	"11.45"	"8.97"	"3.03"	"1.46"	"3"	"MOL"	"0"	"36"	"8"	"2"	"0"	"487.2107"	"BASE"	"C28H29N3O5"	"COc1cc2c(c(OC)n1)[C@]1(O)[C@H](O)[C@H](CN(C)C)[C@@H](c3ccccc3)[C@]1(c1ccc(C#N)cc1)O2"
"CHEMBL221722"	"FAVIPIRAVIR"	"AVIGAN|FAVIPIRAVIR|T-705"	"Small molecule"	"3"	"157.10"	"30"	"529"	"-0.58"	"89.10"	"4"	"2"	"0"	"1"	"N"	"0.57"	"9.39"	"None"	"0.25"	"0.25"	"1"	"MOL"	"0"	"11"	"5"	"3"	"0"	"157.0288"	"NEUTRAL"	"C5H4FN3O2"	"NC(=O)c1nc(F)cnc1O"
"CHEMBL1716983"	"ENISAMIUM IODIDE"	"CARBABENZPYRIDE|ENISAMIUM IODIDE"	"Small molecule"	"3"	"354.19"	"10"	"13"	"1.44"	"32.98"	"1"	"1"	"0"	"3"	"Y"	"0.79"	"13.65"	"None"	"-2.39"	"-2.39"	"2"	"MOL"	"0"	"17"	"3"	"1"	"0"	"227.1179"	"NEUTRAL"	"C14H15IN2O"	"C[n+]1ccc(C(=O)NCc2ccccc2)cc1.[I-]"
"CHEMBL2108163"	"ULINASTATIN"	"AER-002|BIKUNIN|ESTOTIN|MINGIN|MIRACLID|TRYPSIN INHIBITOR UTI-1|ULINASTATIN|URINARY TRYPSIN INHIBITOR 1|URINASTATIN|URISTATIN"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL118"	"CELECOXIB"	"CELECOXIB|Celebra|Celebrex|DFN-15|DFN15|ELYXYB|NSC-719627|NSC-758624|ONSENAL|SC-58635"	"Small molecule"	"4"	"381.38"	"303"	"3101"	"3.51"	"77.98"	"4"	"1"	"0"	"3"	"N"	"0.75"	"10.60"	"None"	"4.01"	"4.01"	"3"	"MOL"	"0"	"26"	"5"	"2"	"0"	"381.0759"	"NEUTRAL"	"C17H14F3N3O2S"	"Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1"
"CHEMBL1454"	"LEVAMISOLE"	"LEVAMISOLE|Levamisole|TCMDC-125847|TETRAMISOLE, (S)-"	"Small molecule"	"4"	"204.30"	"162"	"969"	"2.15"	"15.60"	"3"	"0"	"0"	"1"	"Y"	"0.70"	"None"	"6.98"	"2.36"	"2.22"	"1"	"MOL"	"0"	"14"	"2"	"0"	"0"	"204.0721"	"NEUTRAL"	"C11H12N2S"	"c1ccc([C@H]2CN3CCSC3=N2)cc1"
"CHEMBL3989943"	"DAPANSUTRILE"	"DAPANSUTRILE|OLT-1177|OLT1177"	"Small molecule"	"2"	"133.17"	"3"	"4"	"-0.06"	"57.93"	"3"	"0"	"0"	"2"	"Y"	"0.53"	"None"	"None"	"-1.38"	"-1.38"	"0"	"MOL"	"0"	"8"	"3"	"0"	"0"	"133.0197"	"NEUTRAL"	"C4H7NO2S"	"CS(=O)(=O)CCC#N"
"CHEMBL1082"	"AMOXICILLIN"	"AMIX 125|AMIX 250|AMIX 500|AMOPEN|AMORAM|AMOXICILLIN|AMOXICILLIN (ANHYDROUS)|AMOXICILLIN (AS TRIHYDRATE)|AMOXICILLIN ANHYDROUS|AMOXICILLIN HYDRATE|AMOXICILLIN PEDIATRIC|AMOXICILLIN TRIHYDRATE|AMOXICILLINE|AMOXICILLINUM TRIHYDRICUM|AMOXIDENT 250|AMOXIDENT 500|AMOXIL FIZTAB|AMOXIL SF|AMOXYCILLIN|AMOXYKE|AMOXYMED|AMRIT|ATOKSILIN|Amoxi-Inject|Amoxi-Tabs|Amoxicilline|Amoxil|Amoxycillin|Aquacil|BRL 2333|BRL-2333|Biomox|DAMOXY|DEDOXIL|DEMOKSIL|Dispermox|FLEMOXIN SOLUTAB|GALENAMOX|LARGOPEN|Larotid|MOKSILIN|MOXATAG|NSC-277174|POLYMOX|PROMOXIL|REMOXIL|RESPILLIN|Robamox|Sumox|TOPRAMOXIN|Trimox|UTIMOX|Vetremox|WYMOX|ZOXYCIL 250|ZOXYCIL 500"	"Small molecule"	"4"	"365.41"	"333"	"3811"	"0.02"	"132.96"	"6"	"4"	"0"	"4"	"N"	"0.55"	"3.23"	"7.22"	"-2.31"	"-2.67"	"1"	"MOL"	"0"	"25"	"8"	"5"	"0"	"365.1045"	"ACID"	"C16H19N3O5S"	"CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccc(O)cc3)C(=O)N2[C@H]1C(=O)O"
"CHEMBL4297734"	"CRIZANLIZUMAB"	"Adakveo|CRIZANLIZUMAB|CRIZANLIZUMAB-TMCA|NVP-LXI-262|NVP-LXI262|SEG-101|SEG101|SEL-G1|SELG1|SelG1"	"Antibody"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4650524"	"SOTROVIMAB"	"GSK-4182136|GSK4182136|SOTROVIMAB|VIR-7831|VIR7831"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1088752"	"LOSMAPIMOD"	"FTX-1821|FTX1821|GSK-AHAB|GSKAHAB|GW-856553|GW-856553X|GW856553|GW856553X|LOSMAPIMOD|Losmapimod"	"Small molecule"	"3"	"383.47"	"304"	"353"	"3.86"	"71.09"	"3"	"2"	"0"	"5"	"N"	"0.82"	"13.86"	"2.60"	"3.68"	"3.68"	"2"	"MOL"	"0"	"28"	"5"	"2"	"0"	"383.2009"	"NEUTRAL"	"C22H26FN3O2"	"Cc1c(F)cc(C(=O)NC2CC2)cc1-c1ccc(C(=O)NCC(C)(C)C)cn1"
"CHEMBL682"	"AMODIAQUINE"	"AMODIAQUIN|AMODIAQUINE|AMODIAQUINUM|Amodiaquine|GNF-Pf-5648|NSC-13453|SJ000110703|SUNOQUINE"	"Small molecule"	"4"	"355.87"	"38"	"134"	"5.18"	"48.39"	"4"	"2"	"1"	"6"	"N"	"0.60"	"9.10"	"10.17"	"3.80"	"2.32"	"3"	"MOL"	"0"	"25"	"4"	"2"	"1"	"355.1451"	"BASE"	"C20H22ClN3O"	"CCN(CC)Cc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1O"
"CHEMBL2108494"	"INTERFERON"	"INTERFERON"	"Protein"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4802192"	"ZAPNOMETINIB"	"ATR-002|PD-0184264|ZAPNOMETINIB"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4297887"	"GSK-2586881"	"ALUNACEDASE ALFA|APN-01|APN01|GSK-2586881|GSK2586881"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2108677"	"PEGINTERFERON BETA-1A"	"BIIB-017|BIIB017|PEGINTERFERON BETA|PEGINTERFERON BETA-1A|PLEGRIDY"	"Protein"	"4"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2023898"	"DACLATASVIR"	"BMS 790052|BMS-790052|DACLATASVIR|DAKLINZA|EBP 883|EBP-883"	"Small molecule"	"4"	"738.89"	"33"	"247"	"6.22"	"174.64"	"8"	"4"	"2"	"11"	"N"	"0.14"	"11.15"	"6.09"	"4.18"	"4.16"	"4"	"MOL"	"0"	"54"	"14"	"4"	"3"	"738.3853"	"NEUTRAL"	"C40H50N8O6"	"COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc(-c4cnc([C@@H]5CCCN5C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]4)cc3)cc2)[nH]1)C(C)C"
"CHEMBL1737"	"SILDENAFIL CITRATE"	"NSC-744009|NSC-758669|REVATIO|SILDENAFIL (AS CITRATE)|SILDENAFIL CITRATE|UK-92,480-10|UK-92480-10|Viagra"	"Small molecule"	"4"	"666.71"	"26"	"62"	"1.61"	"113.42"	"8"	"1"	"0"	"7"	"N"	"0.55"	"7.63"	"5.98"	"1.23"	"1.16"	"3"	"MOL"	"0"	"33"	"10"	"1"	"0"	"474.2049"	"NEUTRAL"	"C28H38N6O11S"	"CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)N4CCN(C)CC4)ccc3OCC)nc12.O=C(O)CC(O)(CC(=O)O)C(=O)O"
"CHEMBL4802220"	"BELUDAVIMAB"	"BELUDAVIMAB|VIR-7832"	"Antibody"	"1"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1183717"	"ALMITRINE"	"ALMITRINE"	"Small molecule"	"4"	"477.56"	"4"	"23"	"4.26"	"69.21"	"7"	"2"	"0"	"10"	"N"	"0.42"	"None"	"8.47"	"6.05"	"4.97"	"3"	"MOL"	"0"	"35"	"7"	"2"	"0"	"477.2453"	"NEUTRAL"	"C26H29F2N7"	"C=CCNc1nc(NCC=C)nc(N2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)n1"
"CHEMBL71595"	"HYDROGEN PEROXIDE"	"A-101|CRYSTACIDE|ESKATA|HIOXYL|HYDROGEN PEROXIDE|HYDROGEN PEROXIDE SOLUTION|HYROGEN PEROXIDE|Hydrogen Peroxide|NSC-19892|OXYDOL|PEROXYL"	"Small molecule"	"4"	"34.01"	"36"	"98"	"0.02"	"40.46"	"2"	"2"	"0"	"0"	"Y"	"0.29"	"11.52"	"None"	"-0.45"	"-0.45"	"0"	"MOL"	"0"	"2"	"2"	"2"	"0"	"34.0055"	"NEUTRAL"	"H2O2"	"OO"
"CHEMBL2108264"	"CARRAGEENAN"	"AEC CARRAGEENAN GEL|AEC CARRAGEENAN POWDER|CALCIUM CARRAGEENAN|CARRAGEENAN|CARRAGEENIN|E-407|EUCHEUMAN (FROM EUCHEUMA SPP.)|GENUGEL CARRAGEENAN|GENUVISCO CARRAGEENAN|HYPNEAN (FROM HYPNEA SPP.)|INS NO.407|INS-407|IRIDOPHYCAN (FROM IRIDAEA SPP.)|Marine Colloids|POTASSIUM CARRAGEENAN|SEA SPEN|SEASPEN PF|SODIUM CARRAGEENAN"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL4594287"	"ENSIFENTRINE"	"ENSIFENTRINE|LS-193,855|LS-193855|RPL-554|RPL554"	"Small molecule"	"3"	"477.57"	"1"	"1"	"2.72"	"112.87"	"7"	"2"	"0"	"6"	"N"	"0.57"	"None"	"5.23"	"3.27"	"3.26"	"3"	"MOL"	"0"	"35"	"9"	"3"	"0"	"477.2376"	"NEUTRAL"	"C26H31N5O4"	"COc1cc2c(cc1OC)-c1c/c(=N\c3c(C)cc(C)cc3C)n(CCNC(N)=O)c(=O)n1CC2"
"CHEMBL460026"	"ICOSAPENT"	"ALL-CIS-FATTY ACID 20:5 OMEGA-3|C20:5 (N-3)|EICOSAPENTAENOATE|EICOSAPENTAENOIC ACID|EICOSAPENTAENOIC ACID (C20:5 N3)|EPA 45G|ICOSAPENT|INCROMEGA E 7010SR|OMEGA-3 MARINE TRIGLYCERIDES|ROPUFA 70|TIMNODONIC ACID"	"Small molecule"	"3"	"302.46"	"33"	"54"	"5.99"	"37.30"	"1"	"1"	"1"	"13"	"N"	"0.33"	"4.82"	"None"	"6.23"	"3.69"	"0"	"MOL"	"0"	"22"	"2"	"1"	"1"	"302.2246"	"ACID"	"C20H30O2"	"CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O"
"CHEMBL80830"	"BUCILLAMINE"	"BUCILANT|BUCILLAMINE"	"Small molecule"	"3"	"223.32"	"5"	"25"	"0.19"	"66.40"	"4"	"4"	"0"	"4"	"N"	"0.51"	"3.97"	"None"	"0.52"	"-2.67"	"0"	"MOL"	"0"	"13"	"4"	"2"	"0"	"223.0337"	"ACID"	"C7H13NO3S2"	"CC(C)(S)C(=O)N[C@@H](CS)C(=O)O"
"CHEMBL1496"	"ROSUVASTATIN"	"CRESTON|ROSUVASTATIN|Rosuvastatin|X-PLENDED|ZD-4522|ZD4522"	"Small molecule"	"4"	"481.55"	"34"	"217"	"2.40"	"140.92"	"7"	"3"	"0"	"10"	"N"	"0.47"	"4.00"	"None"	"1.92"	"-1.24"	"2"	"MOL"	"0"	"33"	"9"	"3"	"0"	"481.1683"	"ACID"	"C22H28FN3O6S"	"CC(C)c1nc(N(C)S(C)(=O)=O)nc(-c2ccc(F)cc2)c1/C=C/[C@@H](O)C[C@@H](O)CC(=O)O"
"CHEMBL4297604"	"ACEBILUSTAT"	"ACEBILUSTAT|CTX-4430|EP-501"	"Small molecule"	"2"	"481.55"	""	""	"5.29"	"79.04"	"6"	"1"	"1"	"8"	"N"	"0.37"	"3.78"	"8.04"	"1.91"	"1.84"	"4"	"MOL"	"0"	"36"	"7"	"1"	"1"	"481.2002"	"ACID"	"C29H27N3O4"	"O=C(O)c1ccc(CN2C[C@@H]3C[C@H]2CN3Cc2ccc(Oc3ccc(-c4ncco4)cc3)cc2)cc1"
"CHEMBL2108553"	"PEPPERMINT"	"AE-PEPPERMINT|B1449|BRANDY MINT FLOWERING TOP|LAMB MINT FLOWERING TOP|MENTHA CRISPA FLOWERING TOP|MENTHA DUMETORUM FLOWERING TOP|MENTHA PIPERITA|MENTHA PIPERITA FLOWERING TOP|MENTHA X PIPERITA|MENTHA X PIPERITA FLOWERING TOP|PEPPERMINT|PEPPERMINT FLOWERING TOP|PEPPERMINT POWDER|PEPPERMINT WHOLE|PEPPERMINT, FRESH|PEPPERMINT,FRESH"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL23"	"DILTIAZEM"	"Cardizem|DILTIAZEM|DILTIAZEM EXTENDED RELEASE|DITIAZ|Dilt-CD|Diltiazem|Diltzac|SURAZEM|Tiamate|Tiazac"	"Small molecule"	"4"	"414.53"	"188"	"2285"	"3.37"	"59.08"	"6"	"0"	"0"	"6"	"N"	"0.68"	"12.86"	"8.18"	"2.73"	"1.89"	"2"	"MOL"	"0"	"29"	"6"	"0"	"0"	"414.1613"	"NEUTRAL"	"C22H26N2O4S"	"COc1ccc([C@@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@@H]2OC(C)=O)cc1"
"CHEMBL4650248"	"CASIRIVIMAB"	"CASIRIVIMAB|REGN-10933|REGN10933"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL483"	"TENOFOVIR"	"Atripla|GS-1275|PMP-A|Tenofovir|Truvada"	"Small molecule"	"3"	"287.22"	"64"	"558"	"-0.05"	"136.38"	"7"	"3"	"0"	"5"	"N"	"0.65"	"1.35"	"3.74"	"-3.44"	"-3.55"	"2"	"MOL"	"0"	"19"	"9"	"4"	"0"	"287.0783"	"ACID"	"C9H14N5O4P"	"C[C@H](Cn1cnc2c(N)ncnc21)OCP(=O)(O)O"
"CHEMBL3989873"	"PICLIDENOSON"	"ALB-7208|CF-101|CF101|IB-MECA|PICLIDENOSON"	"Small molecule"	"3"	"510.29"	""	""	"0.41"	"134.42"	"9"	"4"	"1"	"5"	"N"	"0.36"	"12.39"	"4.69"	"0.60"	"0.60"	"3"	"MOL"	"0"	"29"	"10"	"4"	"1"	"510.0513"	"NEUTRAL"	"C18H19IN6O4"	"CNC(=O)[C@H]1O[C@@H](n2cnc3c(NCc4ccc(I)cc4)ncnc32)[C@H](O)[C@@H]1O"
"CHEMBL4650488"	"ETESEVIMAB"	"ANTI-SARS-COV-2 ANTIBODY JS016|CB6|ETESEVIMAB|JS-016|JS016|LY COV016|LY-3832479|LY-COV016|LY3832479|NP-005|NP005"	"Antibody"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"SEQ"	"0"	""	""	""	""	""	""	""	""
"CHEMBL35228"	"PYRONARIDINE"	"MALARIDINE|PYRONARIDINE"	"Small molecule"	"3"	"518.06"	"16"	"81"	"6.09"	"73.75"	"7"	"2"	"2"	"7"	"N"	"0.23"	"7.96"	"10.08"	"4.22"	"2.08"	"4"	"MOL"	"0"	"37"	"7"	"2"	"2"	"517.2245"	"BASE"	"C29H32ClN5O2"	"COc1ccc2nc3cc(Cl)ccc3c(Nc3cc(CN4CCCC4)c(O)c(CN4CCCC4)c3)c2n1"
"CHEMBL4297932"	"DAS-181"	"DAS-181|DAS181|FLUDASE|OPLUNOFUSP"	"Unknown"	"3"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1486"	"TENOFOVIR DISOPROXIL FUMARATE"	"GS-1278|GS-4331-05|GS-4331-05-|GSK-548470|GSK548470|PMPA|PMPA PRODRUG|PMPA Prodrug|PMPA-PRODRUG|TENOFOVIR|TENOFOVIR DF|TENOFOVIR DISOPROXIL FUMARATE|TENOFOVIRI DISOPROXILI FUMARAS|VIREA|Viread"	"Small molecule"	"4"	"635.52"	"21"	"179"	"3.04"	"185.44"	"15"	"1"	"2"	"13"	"N"	"0.23"	"None"	"3.74"	"2.65"	"2.65"	"2"	"MOL"	"0"	"35"	"15"	"2"	"2"	"519.1730"	"NEUTRAL"	"C23H34N5O14P"	"CC(C)OC(=O)OCOP(=O)(CO[C@H](C)Cn1cnc2c(N)ncnc21)OCOC(=O)OC(C)C.O=C(O)/C=C/C(=O)O"
"CHEMBL34259"	"METHOTREXATE"	"(R)-METHOTREXATE|ADX-2191|AMETHOPTERIN|Abitrexate|Amethopterin|CL 14377|CL-14377|D-AMETHOPTERIN|D-METHOTREXATE|EBETREX|EMT-25299|EMTEXATE HIGH-POT|EMTEXATE PF|Folex|MAXTREX|METHOTREXATE|METHOTREXATE, (R)-|METHOTREXATE, D-|METHOTREXATUM|METHYLAMINOPTERIN|METOJECT|Mexate|Mexate-AQ|NSC-740|OTREXUP|OTREXUP PFS|R-9985|R-METHOTREXATE|RASUVO|REDITREX|Rheumatrex|TCMDC-123832|TCMDC-125488|TCMDC-125858|Trexall|ZLATAL|methotrexate"	"Small molecule"	"4"	"454.45"	"913"	"3977"	"0.27"	"210.54"	"10"	"5"	"0"	"9"	"N"	"0.29"	"3.25"	"2.80"	"-0.24"	"-6.56"	"3"	"MOL"	"0"	"33"	"13"	"7"	"2"	"454.1713"	"ACID"	"C20H22N8O5"	"CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1"
"CHEMBL689"	"MANNITOL"	"ARIDOL KIT|Alexitol sodium|BRONCHITOL|CORDYCEPIC ACID|CRYSTALLINE MANNITOL EXTRA-FINE|CRYSTALLINE MANNITOL FINE|CRYSTALLINE MANNITOL STANDARD|D-(-)-MANNITOL|D-MANNITOL|Diosmol|E-421|E421|INS NO.421|INS-421|ISOMALT IMPURITY, MANNITOL-|MANNA SUGAR|MANNITE|MANNITOL|MANNITOL 200|MANNITOL 2080|MANNITOL 25|MANNITOL 300|MANNITOL 35|MANNITOL 60|MANNITOL M300|MANNITOL, D-|MANNITOLUM|MANNOGEM 2080|Mannite|Mannitol|NSC-407017|Osmitrol|PEARLITOL 160 C|PEARLITOL 200 SD|PEARLITOL 25 C|PEARLITOL 300 DC|PEARLITOL 50 C|Resectisol"	"Small molecule"	"4"	"182.17"	"149"	"665"	"-3.59"	"121.38"	"6"	"6"	"1"	"5"	"N"	"0.26"	"12.59"	"None"	"-3.73"	"-3.73"	"0"	"MOL"	"0"	"12"	"6"	"6"	"1"	"182.0790"	"NEUTRAL"	"C6H14O6"	"OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO"
"CHEMBL1218"	"RAMELTEON"	"RAMELTEON|Rozerem|TAK-375|TAK375"	"Small molecule"	"4"	"259.35"	"21"	"41"	"2.57"	"38.33"	"2"	"1"	"0"	"4"	"N"	"0.90"	"None"	"None"	"2.57"	"2.57"	"1"	"MOL"	"0"	"19"	"3"	"1"	"0"	"259.1572"	"NEUTRAL"	"C16H21NO2"	"CCC(=O)NCC[C@@H]1CCc2ccc3c(c21)CCO3"
"CHEMBL1259059"	"SOFOSBUVIR"	"GS-7977|GS7977|PSI-7977|PSI-7977, GS-7977|SOFOSBUVIR|SOVALDI"	"Small molecule"	"4"	"529.46"	"32"	"214"	"1.66"	"158.18"	"10"	"3"	"1"	"10"	"N"	"0.31"	"9.70"	"None"	"1.28"	"1.28"	"2"	"MOL"	"0"	"36"	"12"	"3"	"2"	"529.1625"	"NEUTRAL"	"C22H29FN3O9P"	"CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](C)(F)[C@@H]1O)Oc1ccccc1"
"CHEMBL2110563"	"CYANOCOBALAMIN"	"ANTIPERNICIN|BEHEPAN|Berubigen|Betalin 12|CALOMIST|CYANOCOBALAMIN|CYANOCOBALAMINUM|CYANOCOBALMIN|CYANOVIT-B12|CYCOBEMIN|CYTACON|CYTAMEN|Cobavite|DODECAVITE|DODEX|NORMOCYTIN|NSC-80365|Nascobal|PLECYAMIN|RUBIVAMINE|RUBIVITE|RUBRAMIN PC|RUVITE|Redisol|Rubramin|VI-TWEL|VIBISONE|VITAMIN B 12|VITAMIN B(BDI1)(BDI2)|VITAMIN B-12|VITAMIN B12|VITAMIN B12 (AS CYANOCOBALAMIN )|VITAMIN B12 NOS|Vibalt|Vitamin B 12"	"Small molecule"	"4"	"1356.40"	"3"	"7"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"None"	"NONE"	"0"	"None"	"None"	"None"	"None"	"1355.5752"	"None"	"C63H89CoN14O14P"	""
"CHEMBL129"	"ZIDOVUDINE"	"3'-AZT|AZIDOTHYMIDINE|AZT|Azidothymidine|BW A509U|BW-A-509U|BW-A509U|BWA509U|COMPOUND S|COMPOUND-S|NSC-602670|Retrovir|ZIDOVUDINE|ZIDOVUDINUM"	"Small molecule"	"4"	"267.25"	"300"	"4146"	"-0.20"	"133.08"	"6"	"2"	"0"	"3"	"N"	"0.45"	"9.96"	"None"	"-0.30"	"-0.41"	"1"	"MOL"	"0"	"19"	"9"	"2"	"0"	"267.0968"	"NEUTRAL"	"C10H13N5O4"	"Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)c(=O)[nH]c1=O"
"CHEMBL4802135"	"PF-07321332"	"PF-07321332|PF07321332"	"Small molecule"	"2"	"499.53"	""	""	"1.10"	"131.40"	"5"	"3"	"0"	"6"	"N"	"0.50"	"7.10"	"None"	"0.44"	"0.05"	"0"	"MOL"	"0"	"35"	"9"	"3"	"0"	"499.2406"	"NEUTRAL"	"C23H32F3N5O4"	"CC(C)(C)[C@H](NC(=O)C(F)(F)F)C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@H](C#N)C[C@@H]1CCNC1=O)C2(C)C"
"CHEMBL790"	"CHLORHEXIDINE"	"Avagard|CHLORHEXADINE|CHLORHEXIDINE|Chlorhexidine|DENTISEPT|Exidine|Hibistat|MERFEN-INCOLORE"	"Small molecule"	"4"	"505.46"	"116"	"440"	"4.18"	"167.58"	"4"	"10"	"2"	"9"	"N"	"0.14"	"None"	"10.45"	"4.51"	"-1.30"	"2"	"MOL"	"0"	"34"	"10"	"10"	"2"	"504.2032"	"BASE"	"C22H30Cl2N10"	"N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1"
"CHEMBL4594593"	"REGN-3051"	"REGN-3051|REGN3051"	"Unknown"	"1"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL2393130"	"APABETALONE"	"APABETALONE|RVX-000222|RVX-208|RVX000222"	"Small molecule"	"3"	"370.41"	"40"	"222"	"2.60"	"93.67"	"6"	"2"	"0"	"6"	"N"	"0.69"	"7.89"	"2.78"	"2.49"	"2.39"	"3"	"MOL"	"0"	"27"	"7"	"2"	"0"	"370.1529"	"NEUTRAL"	"C20H22N2O5"	"COc1cc(OC)c2c(=O)[nH]c(-c3cc(C)c(OCCO)c(C)c3)nc2c1"
"CHEMBL2108506"	"INTERFERON ALFA"	"INTERF|INTERFERON ALFA|INTERFERON ALFA NATURAL|INTERFERON ALPHA|ROFERON-A|VIRAFERON|WELLFERON"	"Protein"	"4"	""	"2"	"19"	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL787"	"MONTELUKAST"	"BRONDILAT|MK-476|MONTELUKAST|Montelukast|SINGULAIR"	"Small molecule"	"4"	"586.20"	"125"	"395"	"8.95"	"70.42"	"4"	"2"	"2"	"12"	"N"	"0.17"	"4.40"	"3.12"	"8.49"	"5.80"	"4"	"MOL"	"0"	"41"	"4"	"2"	"2"	"585.2104"	"ACID"	"C35H36ClNO3S"	"CC(C)(O)c1ccccc1CC[C@@H](SCC1(CC(=O)O)CC1)c1cccc(/C=C/c2ccc3ccc(Cl)cc3n2)c1"
"CHEMBL4802163"	"NEZULCITINIB"	"NEZULCITINIB|TD-0903|THRX-136377"	"Small molecule"	"2"	"527.67"	""	""	"3.80"	"104.38"	"6"	"3"	"1"	"6"	"N"	"0.35"	"9.77"	"7.87"	"3.65"	"3.03"	"4"	"MOL"	"0"	"39"	"9"	"3"	"1"	"527.3009"	"NEUTRAL"	"C30H37N7O2"	"CCc1cc(O)ccc1-c1ccc2c(-c3nc4c([nH]3)C[C@@H](C(=O)N3CC(N(C)C)C3)N(C(C)C)C4)n[nH]c2c1"
"CHEMBL4297680"	"1018 ISS"	"1018 ISS|CPG 1018|CPG OLIGONUCLEOTIDE 1018 ISS|CPG-1018|ISS 1018|ISS-1018"	"Unknown"	"2"	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	""	"NONE"	"0"	""	""	""	""	""	""	""	""
"CHEMBL1201129"	"DECITABINE"	"2'-DEOXY-5-AZACYTIDINE|DAC|DECITABINE|Dacogen|NSC-127716"	"Small molecule"	"4"	"228.21"	"98"	"156"	"-2.14"	"123.49"	"8"	"3"	"0"	"2"	"N"	"0.53"	"13.89"	"None"	"-2.16"	"-2.16"	"1"	"MOL"	"0"	"16"	"8"	"4"	"0"	"228.0859"	"NEUTRAL"	"C8H12N4O4"	"Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1"
"CHEMBL3989798"	"FORMOTEROL FUMARATE"	"ATIMOS MODULITE|ATOCK|BD 40A|BD-40A|CGP 25827A|CGP-25827A|EFORMOTEROL|FOMOTEROL FUMARATE|FORADIL CERTIHALER|FORASEQ|FORMOTEROL FUMARATE|FORMOTEROL FUMARATE (SUPERCEDED)|FORMOTEROL FUMARATE ANHYDROUS|FORMOTEROL FUMARATE DIHYDRATE|FORMOTEROL FUMARATE HYDRATE|FORMOTEROL HEMIFUMARATE|Foradil|NSC-299587|OXEZE|OXIS 12|OXIS 6|PERFOROMIST|Performist|YM-08316"	"Small molecule"	"4"	"840.92"	"2"	"4"	"2.22"	"90.82"	"5"	"4"	"0"	"9"	"N"	"0.41"	"8.61"	"9.81"	"1.06"	"0.04"	"2"	"MOL"	"0"	"25"	"6"	"4"	"0"	"344.1736"	"BASE"	"C42H56N4O14"	"COc1ccc(CC(C)NCC(O)c2ccc(O)c(NC=O)c2)cc1.COc1ccc(CC(C)NCC(O)c2ccc(O)c(NC=O)c2)cc1.O.O.O=C(O)/C=C/C(=O)O"
"CHEMBL941"	"IMATINIB"	"GLAMOX|Gleevec|IMATINIB|Imatinib|NSC-743414|NSC-759854|STI-571"	"Small molecule"	"4"	"493.62"	"1332"	"4338"	"4.59"	"86.28"	"7"	"2"	"0"	"7"	"N"	"0.39"	"12.69"	"7.84"	"4.38"	"3.80"	"4"	"MOL"	"0"	"37"	"8"	"2"	"0"	"493.2590"	"NEUTRAL"	"C29H31N7O"	"Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1"
"CHEMBL191"	"LOSARTAN"	"ALLISARTAN|ANGIZAAR|DUP-89|HGP-1405|HGP1405|LOSARTAN|LOSARTIC|LOZAP|Losartan|NSC-758699"	"Small molecule"	"4"	"422.92"	"167"	"1272"	"4.27"	"92.51"	"6"	"2"	"0"	"8"	"N"	"0.44"	"4.26"	"3.82"	"4.06"	"2.82"	"4"	"MOL"	"0"	"30"	"7"	"2"	"0"	"422.1622"	"ACID"	"C22H23ClN6O"	"CCCCc1nc(Cl)c(CO)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1"
"CHEMBL916"	"TIROFIBAN"	"AGRASTAT|Aggrastat|L-700462|MK-383|TIROFIBAN|Tirofiban"	"Small molecule"	"4"	"440.61"	"27"	"116"	"2.95"	"104.73"	"5"	"3"	"0"	"14"	"N"	"0.38"	"3.17"	"10.21"	"0.60"	"0.60"	"1"	"MOL"	"0"	"30"	"7"	"3"	"0"	"440.2345"	"ZWITTERION"	"C22H36N2O5S"	"CCCCS(=O)(=O)N[C@@H](Cc1ccc(OCCCCC2CCNCC2)cc1)C(=O)O"