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Profile: Biotrend Chemicals AG supplies complex organic chemicals for biomedical research. Our products are used in biotechnology based corporations, pharmaceutical and diagnostic companies, hospitals, universities and research institutions. We also provide conjugation service, custom antibody production, custom antibody production packages and custom labeling services.

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• Etoposide

IUPAC Name: (5R,5aR,8aR,9S)-9-[[(2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-5-(4-hydroxy-3,5-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-6-one | CAS Registry Number: 33419-42-0
Synonyms: etoposide, VePesid, Lastet, trans-Etoposide, Zuyeyidal, Toposar, (-)-Etoposide, Vepesid J, Vepeside, Eposide, Etopol, Etosid, Etoposide (VP16), Etoposidum [INN-Latin], EPEG, Etoposido [INN-Spanish], VP 16 (pharmaceutical), Ambap1061, Etopophos (phosphate salt), VePESID (TN)

Molecular Formula:	C₂₉H₃₂O₁₃	Molecular Weight:	588.556580 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	13

InChIKey: VJJPUSNTGOMMGY-MRVIYFEKSA-N

• Evodiamine

Synonyms: Evodiamine, Evodia rutaecarpa, BB_NC-1930, CID442088, ZINC00898159, C09187
Molecular Formula: C₁₉H₁₇N₃O Molecular Weight: 303.357780 [g/mol]
H-Bond Donor: 1 H-Bond Acceptor: 3

InChIKey: TXDUTHBFYKGSAH-SFHVURJKSA-N

• Exenatide

Synonyms: Exendin 4, Exendin-4, Bydureon, Byetta, AC 2993, exenatida, exenatidum, Bydureon Pen, UNII-9P1872D4OL, CHEBI:64073, Exendin 4 (Heloderma suspectum), HSDB 7789, Exenatide [USAN:INN:BAN:JAN], 9P1872D4OL, PT302, AC 2993A, DA 3091, Heloderma suspectum gila monster exendin-4, LY2148568, LY 2148568

Molecular Formula:	C₁₈₄H₂₈₂N₅₀O₆₀S	Molecular Weight:	4186.571880 [g/mol]
H-Bond Donor:	58	H-Bond Acceptor:	66

InChIKey: HTQBXNHDCUEHJF-URRANESESA-N

• Ezetimibe

IUPAC Name: (3R,4S)-1-(4-fluorophenyl)-3-[(3S)-3-(4-fluorophenyl)-3-hydroxypropyl]-4-(4-hydroxyphenyl)azetidin-2-one | CAS Registry Number: 163222-33-1
Synonyms: Zetia, Vytorin, Ezedoc, Ezetrol, Zient, Mixture Name, Zetia (TN), Ezetimibe [USAN:INN], Sch 58235, Ezetimibe (JAN/USAN/INN), MLS000759443, MLS001424125, CHEBI:49040, (-)-Sch 58235, CID150311, SCH-58235, DB00973, MK-0653, CPD000466334, SAM001246623

Molecular Formula:	C₂₄H₂₁F₂NO₃	Molecular Weight:	409.425246 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: OLNTVTPDXPETLC-XPWALMASSA-N

• Famotidine

IUPAC Name: 3-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]methylsulfanyl]-N'-sulfamoylpropanimidamide | CAS Registry Number: 76824-35-6
Synonyms: famotidine, Gastridin, Pepcidine, Quamatel, Famodil, Pepdine, Gaster, Pepdul, Apogastine, Gastrodomina, Gastrosidin, Supertidine, Antodine, Bestidine, Blocacid, Confobos, Digervin, Dispromil, Dispronil, Fagastine

Molecular Formula:	C₈H₁₅N₇O₂S₃	Molecular Weight:	337.445400 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	9

InChIKey: XUFQPHANEAPEMJ-UHFFFAOYSA-N

• Fasudil

IUPAC Name: 5-(1,4-diazepan-1-ylsulfonyl)isoquinoline | CAS Registry Number: 103745-39-7
Synonyms: Eril, Fasudil [INN], 2esm, 2gni, Fasudil hydrochloride, Fasudilum [INN-Latin], Tocris-0541, 1q8w, BiomolKI_000038, BiomolKI2_000046, Fasudil (HA-1077), ha-1077, BSPBio_001111, KBioGR_000451, KBioSS_000451, AT 877, HA1077, C14H17N3O2S, HA 1077, KBio2_000451

Molecular Formula:	C₁₄H₁₇N₃O₂S	Molecular Weight:	291.368680 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: NGOGFTYYXHNFQH-UHFFFAOYSA-N

• FCCP

IUPAC Name: 2-[[4-(trifluoromethoxy)phenyl]hydrazinylidene]propanedinitrile | CAS Registry Number: 370-86-5
Synonyms: Maybridge1_007693, BSPBio_001069, KBioGR_000409, KBioSS_000409, C2920_SIGMA, EINECS 206-730-8, KBio2_000409, KBio2_002977, KBio2_005545, KBio3_000777, KBio3_000778, CID3330, Bio1_000432, Bio1_000921, Bio1_001410, Bio2_000365, Bio2_000845, SEW04952, BRN 4693268, ZINC00110861

Molecular Formula:	C₁₀H₅F₃N₄O	Molecular Weight:	254.168110 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: BMZRVOVNUMQTIN-UHFFFAOYSA-N

• Felbamate

IUPAC Name: (3-carbamoyloxy-2-phenylpropyl) carbamate | CAS Registry Number: 25451-15-4
Synonyms: felbamate, Felbatol, Felbamyl, Taloxa, Felbamatum [Latin], Felbamato [Spanish], Felbatol (TN), Felbamate [USAN:INN], Tocris-0869, Felbamate (USAN/INN), Prestwick0_000919, Lopac-F-0778, Biomol-NT_000203, Lopac0_000524, 2-Phenyl-1,3-propanediol dicarbamate, MLS000028465, MLS000758238, MLS001077299, F0778_SIGMA, BPBio1_001258

Molecular Formula:	C₁₁H₁₄N₂O₄	Molecular Weight:	238.239860 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: WKGXYQFOCVYPAC-UHFFFAOYSA-N

• Felodipine

IUPAC Name: 3-O-ethyl 5-O-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate | CAS Registry Number: 72509-76-3
Synonyms: felodipine, Plendil, Perfudal, Munobal, Flodil, Modip, Splendil, Renedil, Prevex, Hydac, Agon, dl-Felodipine, Felogard, Feloday, Penedil, Preslow, Lexxel, Munobal Retard, Plendil Retard, Plendil Depottab

Molecular Formula:	C₁₈H₁₉Cl₂NO₄	Molecular Weight:	384.253760 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: RZTAMFZIAATZDJ-UHFFFAOYSA-N

• Felypressin

IUPAC Name: N-[6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexan-2-yl]-1-[16-amino-4-(2-amino-2-oxoethyl)-7-(3-amino-3-oxopropyl)-10,13-dibenzyl-3,6,9,12,15-pentaoxo-18,19-dithia-2,5,8,11,14-pentazacycloicosane-1-carbonyl]pyrrolidine-2-carboxamide | CAS Registry Number: 56-59-7
Synonyms: Felypressinum, Felipresina, Felipressina, Felypressine, Octapressin, Octopressin, Phelypressin, FELYPRESSIN, Felipressina [DCIT], Felipresina [INN-Spanish], Felypressine [INN-French], Felypressinum [INN-Latin], PLV-2, Felypressin [USAN:INN:BAN], Vasopressin, Phenylalanyl-Lysyl, Phenylalanine Lysine Vasopressin, UNII-17N2918V6G, EINECS 200-282-7, CID5956, C4H10

Molecular Formula:	C₄₆H₆₅N₁₃O₁₁S₂	Molecular Weight:	1040.218800 [g/mol]
H-Bond Donor:	12	H-Bond Acceptor:	13

InChIKey: SFKQVVDKFKYTNA-UHFFFAOYSA-N

• Fenobam

IUPAC Name: 1-(3-chlorophenyl)-3-(3-methyl-5-oxo-4H-imidazol-2-yl)urea | CAS Registry Number: 57653-26-6
Synonyms: Fenobamum [INN-Latin], F0430_SIGMA, McN-3377, NPL-2009, NCGC00092384-01, LS-193274, N-(3-Chlorophenyl)-N'-(4,5-dihydro-1-methyl-4-oxo-1H-imidazol-2-yl)urea, N-(3-Chlorophenyl)-N'-(4,5-dihydro-1-methyl-4-oxo-1H-imidazole-2-yl)urea, Urea, N-(3-chlorophenyl)-N'-(4,5-dihydro-1-methyl-4-oxo-1H-imidazol-2-yl)-

Molecular Formula:	C₁₁H₁₁ClN₄O₂	Molecular Weight:	266.683640 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: DWPQODZAOSWNHB-UHFFFAOYSA-N

• Fenofibrate

IUPAC Name: propan-2-yl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate | CAS Registry Number: 49562-28-9
Synonyms: fenofibrate, Lipantil, Tricor, Procetofen, Lipanthyl, Triglide, Lipidil, Secalip, Antara, Finofibrate, Proctofene, Lipoclar, Fenogal, Lipirex, Sedufen, Phenofibrate, Elasterate, Procetofene, Protolipan, Elasterin

Molecular Formula:	C₂₀H₂₁ClO₄	Molecular Weight:	360.831340 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: YMTINGFKWWXKFG-UHFFFAOYSA-N

• Fenoterol Hydrobromide

IUPAC Name: 5-[1-hydroxy-2-[1-(4-hydroxyphenyl)propan-2-ylamino]ethyl]benzene-1,3-diol hydrobromide | CAS Registry Number: 1944-12-3
Synonyms: Fenoterol hydrobromide, Berotec, Prestwick_667, Berotec (TN), Fenoterol hydrobromide (JAN), MLS001056741, F1016_SIGMA, SPECTRUM1501007, CID5702161, NCGC00093932-01, NCGC00093932-02, NCGC00093932-03, NCGC00093932-04, SMR000326705, EU-0100544, D01428, 2-(3,5-Dihydroxyphenyl)-2-hydroxy-2'-(4-hydroxyphenyl)-1'-methyldiethylamine hydrobromide

Molecular Formula:	C₁₇H₂₂BrNO₄	Molecular Weight:	384.264880 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	5

InChIKey: SGZRQMALQBXAIQ-UHFFFAOYSA-N

• Fenretinide

IUPAC Name: (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenamide | CAS Registry Number: 65646-68-6
Synonyms: FENRETINIDE, Fenretinimide, 4-hydroxyphenylretinamide, Fenretinidum [Latin], N-(4-Hydroxyphenyl)retinamide, Fenretinida [Spanish], 4-Hydroxyphenyl retinamide, 4-(hydroxyphenyl)retinamide, 4HPR, nchembio873-comp11, 4-HPR, Fenretinide [USAN:INN], McN-R-1967, 4 Hydroxyphenylretinamide, Spectrum5_001939, Fenretinide (USAN/INN), 13-cis-Isomer Fenretinide, all-trans-4'-Hydroxyretinanilide, Retinoic acid p-hydroxyanilide, CCRIS 3260

Molecular Formula:	C₂₆H₃₃NO₂	Molecular Weight:	391.545720 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: AKJHMTWEGVYYSE-FXILSDISSA-N

• Fexofenadine

IUPAC Name: 2-[4-[1-hydroxy-4-[4-[hydroxy-di(phenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid | CAS Registry Number: 83799-24-0
Synonyms: fexofenadine, Carboxyterfenadine, Terfenadine-COOH, Fexofendine, Terfenadine carboxylate, Terfenadine acid metabolite, Spectrum_001914, Spectrum2_001179, Spectrum3_001921, Spectrum4_000204, Spectrum5_001474, Fexofenadine [INN:BAN], FEXOFENADINE HYDROCHLORIDE, Lopac0_000488, BSPBio_003521, KBioGR_000807, KBioSS_002456, SPBio_001197, C32H39NO4, HSDB 7486

Molecular Formula:	C₃₂H₃₉NO₄	Molecular Weight:	501.656360 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: RWTNPBWLLIMQHL-UHFFFAOYSA-N

• Finasteride

IUPAC Name: (1S,3aS,3bS,5aR,9aR,9bS,11aS)-N-tert-butyl-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide | CAS Registry Number: 98319-26-7
Synonyms: finasteride, Propecia, Proscar, Chibro-Proscar, Finastid, Prostide, Finpecia, Eucoprost, Propeshia, Andozac, Prodel, Chibro Proscar, Propecia (TN), Proscar (TN), Finasteridum [INN-Latin], Finasterida [INN-Spanish], Finasteride (USP/INN), Prestwick0_000717, Prestwick1_000717, Prestwick2_000717

Molecular Formula:	C₂₃H₃₆N₂O₂	Molecular Weight:	372.544140 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: DBEPLOCGEIEOCV-WSBQPABSSA-N

• Flucloxacillin Sodium

IUPAC Name: sodium (2S,5R,6R)-6-[[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate | CAS Registry Number: 1847-24-1
Synonyms: Floxapen sodium, Floxacillin sodium, flucloxacillin sodium, Floxacillin Na salt, Sodium flucloxacillin, Stafopen sodium salt, Staphylex Sodium salt, Flucloxacillin sodium salt, Flucloxacillin-Sodium, MFI-PC, Monosodium flucloxacillin, CHEBI:31615, EINECS 217-428-0, NSC 277175, NSC277175, LS-149762, 5-Methyl-3-(2-chloro-6-fluorophenyl)-4-isoxazolylpenicillin sodium, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl)carbonyl)amino)-3,3-dimethyl-7-oxo-, monosodium salt, (2S,5R,6R)-, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolyl)carbonyl)amino)-3,3-dimethyl-7-oxo-, monosodium salt, (2S-(2-alpha,5-alpha,6-beta))-, Sodium (2S-(2alpha,5alpha,6beta))-6-(((3-(2-chloro-6-fluorophenyl)-5-methylisoxazol-4-yl)carbonyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate

Molecular Formula:	C₁₉H₁₆ClFN₃NaO₅S	Molecular Weight:	475.853613 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	7

InChIKey: OTEANHMVDHZOPB-SLINCCQESA-M

• Fluconazole

IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol | CAS Registry Number: 86386-73-4
Synonyms: fluconazole, Triflucan, Diflucan, Biozolene, Elazor, Biocanol, Fungata, Zonal, Alflucoz, Flucazol, Flukezol, Flunizol, Oxifugol, Pritenzol, Afungil, Cryptal, Dimycon, Fluzone, Canzol, Forcan

Molecular Formula:	C₁₃H₁₂F₂N₆O	Molecular Weight:	306.270786 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	9

InChIKey: RFHAOTPXVQNOHP-UHFFFAOYSA-N

• Flumazenil

IUPAC Name: ethyl 8-fluoro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate | CAS Registry Number: 78755-81-4
Synonyms: flumazenil, Romazicon, Flumazepil, Anexate, Lanexat, Mazicon, Flumazenilum [Latin], Flumazenilo [Spanish], Romazicon (TN), nchembio747-comp37, Ambap2342, Tocris-1328, Lopac-F-6300, Biomol-NT_000285, UPCMLD-DP137, Flumazenil [USAN:BAN:INN], Lopac0_000506, Flumazenil (JAN/USP/INN), MLS000028850, MLS000759529

Molecular Formula:	C₁₅H₁₄FN₃O₃	Molecular Weight:	303.288363 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: OFBIFZUFASYYRE-UHFFFAOYSA-N

• Fluoxetin Hcl

IUPAC Name: N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine hydrochloride | CAS Registry Number: 59333-67-4
Synonyms: Prozac, Fluoxeren, Flunirin, Fluctin, Adofen, Lovan, Equilibrane, Rowexetina, Affectine, Bioxetin, Deproxin, Digassim, Felicium, Fluctine, Fluneurin, Fluoxifar, Margrilan, Mitilase, Modipran, Motivone

Molecular Formula:	C₁₇H₁₉ClF₃NO	Molecular Weight:	345.787070 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: GIYXAJPCNFJEHY-UHFFFAOYSA-N

• Fluphenazine

IUPAC Name: 2-[4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethanol | CAS Registry Number: 69-23-8
Synonyms: Triflumethazine, FLUPHENAZINE, Fluorophenazine, Phthorphenazine, Fluorfenazine, Fluorphenazine, Ftorphenazine, Siqualine, Vespazine, Siqualon, Pacinol, Elinol, Valamina, Sevinol, Dapotum, Calmansial, Flufenazin, Anatensol, Prolixin, Lyogen

Molecular Formula:	C₂₂H₂₆F₃N₃OS	Molecular Weight:	437.521550 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	7

InChIKey: PLDUPXSUYLZYBN-UHFFFAOYSA-N

• Flupirtine Maleate

IUPAC Name: (Z)-but-2-enedioic acid; ethyl N-[2-amino-6-[(4-fluorophenyl)methylamino]pyridin-3-yl]carbamate | CAS Registry Number: 75507-68-5
Synonyms: Flupirtine maleate, Katadolon, Effirma, Flupirtin-maleat [German], Flupirtine maleate [USAN], flupirtine maleate (1:1), Flupirtine maleate (USAN), F8927_SIGMA, EINECS 278-225-0, W 2964M, C15H18N4O2.C4H4O4, NCGC00093935-01, LS-48933, EU-0100547, D-9998, D04226, Ethyl 2-amino-6-((p-fluorobenzyl)amino)-3-pyridinecarbamate maleate (1:1), Ethyl-N-(2-amino-6-(4-fluorophenylmethylamino)pyridin-3-yl)carbamate maleate, (2-Amino-6-(((4-fluorophenyl)methyl)amino)-3-pyridinyl)carbamic acid ethyl ester maleate, Ethyl 2-amino-6-((4-fluorobenzyl)amino)pyridine-3-carbamate, compound with maleic acid (1:1)

Molecular Formula:	C₁₉H₂₁FN₄O₆	Molecular Weight:	420.391643 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	10

InChIKey: DPYIXBFZUMCMJM-BTJKTKAUSA-N

• Fluvastatin Sodium

IUPAC Name: sodium (E,3S,5S)-7-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3,5-dihydroxyhept-6-enoate | CAS Registry Number: 93957-55-2
Synonyms: Lescol, Lescol (TN), FLUVASTATIN SODIUM, Fluvastatin sodium (JAN/USAN), D00892

Molecular Formula:	C₂₄H₂₅FNNaO₄	Molecular Weight:	433.447773 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: ZGGHKIMDNBDHJB-VASWWXHQSA-M

• Fluvoxamine Maleate

IUPAC Name: (Z)-but-2-enedioic acid; 2-[[5-methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]amino]oxyethanamine | CAS Registry Number: 61718-82-9
Synonyms: Luvox, FLUVOXAMINE MALEATE, fluvoxamine, Depromel, Floxyfral, Faverin, Fevarin, Luvox CR, Luvox (TN), Fluvoxamine maleate [USAN], F2802_SIGMA, SME 3110, Fluvoxamine maleate (JAN/USAN), DU23000, SME-3110, MK-264, NSC309469, C15H21F3N2O2.C4H4O4, NSC 309469, NCGC00093897-01

Molecular Formula:	C₁₉H₂₅F₃N₂O₆	Molecular Weight:	434.406810 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	11

InChIKey: LFMYNZPAVPMEGP-PIDGMYBPSA-N

• Formoterol Fumarate

IUPAC Name: (E)-but-2-enedioic acid; N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide; N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide | CAS Registry Number: 43229-80-7
Synonyms: Foradil, Foradil (TN), FORMOTEROL FUMARATE, Formoterol fumarate (USAN), D01373

Molecular Formula:	C₄₂H₅₂N₄O₁₂	Molecular Weight:	804.881880 [g/mol]
H-Bond Donor:	10	H-Bond Acceptor:	14

InChIKey: OBRNDARFFFHCGE-WXXKFALUSA-N

• Forskolin

IUPAC Name: [(3R,4aR,5S,6S,6aS,10S,10aR,10bS)-3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] acetate | CAS Registry Number: 66575-29-9
Synonyms: forskolin, Colforsin, Coleonol, colforsina, colforsine, colforsinum, Boforsin, Ocufors, Adehl, Colforsine [French], Colforsinum [Latin], Colforsina [Spanish], Colforsin [USAN:INN], nchembio.79-comp16, Ambap3655, Colforsin (USAN/INN), forskolin/ rolipram mixture, MolMap_000021, MLS001066384, MLS001333255

Molecular Formula:	C₂₂H₃₄O₇	Molecular Weight:	410.501160 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: OHCQJHSOBUTRHG-KGGHGJDLSA-N

• Foscarnet Sodium

IUPAC Name: trisodium phosphonatoformate | CAS Registry Number: 63585-09-1
Synonyms: Foscavir, Triapten, foscarnet, FOSCARNET SODIUM, Virudin, Foscavir (TN), Trisodium carboxyphosphate, Trisodium phosphonoformate, Foscarnet sodico [Spanish], Foscarnet sodique [French], Foscarnetum natricum [Latin], Foscarnet sodique [INN-French], Foscarneto sodico [INN-Spanish], SPECTRUM1502019, EHB 776, Foscarnet sodium (USAN/INN), Foscarnetum natricum [INN-Latin], DRG-0017, Phosphonoformic acid, trisodium salt, EHB-776

Molecular Formula:	CNa₃O₅P	Molecular Weight:	191.950771 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: DFHAXXVZCFXGOQ-UHFFFAOYSA-K

• Frusemide

IUPAC Name: 4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoic acid | CAS Registry Number: 54-31-9
Synonyms: furosemide, Lasix, Furanthril, Furosemid, Fursemide, Errolon, Fusid, Fuluvamide, Furanthryl, Macasirool, Furantril, Lowpstron, Aisemide, Beronald, Desdemin, Frusemid, Frusemin, Fursemid, Prefemin, Rosemide

Molecular Formula:	C₁₂H₁₁ClN₂O₅S	Molecular Weight:	330.744140 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: ZZUFCTLCJUWOSV-UHFFFAOYSA-N

• Fumagillin

IUPAC Name: (2E,4E,6E,8E)-10-[[(3S,4R,5R,6S)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl]oxy]-10-oxodeca-2,4,6,8-tetraenoic acid | CAS Registry Number: 23110-15-8
Synonyms: fumagillin, Amebacillin, Fugillin, Fugilin, Fumadil B, NSC9168, AIDS002168, AIDS-002168, CID6473755, NSC58368 (DICYCLOHEXYLAMINE SALT), 2,4,6,8-Decatetraenedioic acid, mono(5-methoxy-4-(2-methyl-3-(3-methyl-2-butenyl)oxiranyl)-1-oxaspiro(2.5)oct-6-yl) ester, (3R-(3alpha,4alpha(2R*,3R*),5beta,6beta(all-E-)))-

Molecular Formula:	C₂₆H₃₄O₇	Molecular Weight:	458.543960 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	7

InChIKey: NGGMYCMLYOUNGM-TWKZINDSSA-N

• Gabapentin

IUPAC Name: 2-[1-(aminomethyl)cyclohexyl]acetic acid | CAS Registry Number: 60142-96-3
Synonyms: gabapentin, Neurontin, Gabapetin, Gabapentine, Aclonium, Gabapentin GR, Gabapen, Novo-Gabapentin, Apo-Gabapentin, Gabapentin Hexal, Gabapentin Stada, PMS-Gabapentin, Gabapentino [Spanish], Neurontin (TN), Prestwick_151, Gabapentin-ratiopharm, Gabapentine [INN-French], Gabapentinum [INN-Latin], Gabapentino [INN-Spanish], gabapentin (Neurontin)

Molecular Formula:	C₉H₁₇NO₂	Molecular Weight:	171.236780 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: UGJMXCAKCUNAIE-UHFFFAOYSA-N

• Gabexate mesilate

IUPAC Name: [N'-[6-(4-ethoxycarbonylphenoxy)-6-oxohexyl]carbamimidoyl]azanium; methanesulfonate | CAS Registry Number: 39492-01-8
Synonyms: Gabexate mesylate, Gabexate monomethanesulfonate, Gabexato mesilato [Spanish], C16H23N3O4.CH4O3S, LS-35906, Ethyl p-(6-guanidinohexanoxyloxy)benzoate methanesulfonate, Ethyl p-(6-guanidinohexanoyloxy) benzoate methanesulfonate, p-Hydroxybenzoic acid ethyl ester 6-guanidinohexanoate mesilate, Benzoic acid, 4-((6-((aminoiminomethyl)amino)-1-oxohexyl)oxy)-, ethyl ester, monomethanesulfonate, FOY, BENZOIC ACID, 4-((6-((AMINOIMINOMETHYL)AMINO)-1-OXOHEXYL)OXY)-, ETHYL ESTER, MON, 56974-61-9, Benzoic acid, 4-((6-((aminoiminomethyl)amino)-1-oxohexyl)oxy)-, ethyl ester,monomethanesulfonate

Molecular Formula:	C₁₇H₂₇N₃O₇S	Molecular Weight:	417.477180 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	9

InChIKey: DNTNDFLIKUKKOC-UHFFFAOYSA-N

• Galantamine Hydrobromide

Synonyms: Razadyne, Nivalin, Reminyl, galanthamine, Nivaline, Galantamine hydrobromide, anti-Alzheimer, Galanthamine hydrobromide, Jilkon hydrobromide, Reminyl XL, Razadyne (TN), Lycoremine hydrobromide, Prestwick_236, Nivaline (pharmaceutical), Galantamine hydrobromide, Galanthamine hydrogen bromide, Nivaline (C17 pharmaceutical), MLS000758283, MLS001401401, G1660_SIGMA

Molecular Formula:	C₁₇H₂₂BrNO₃	Molecular Weight:	368.265480 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: QORVDGQLPPAFRS-XPSHAMGMSA-N

• Ganciclovir

IUPAC Name: 2-amino-9-(1,3-dihydroxypropan-2-yloxymethyl)-3H-purin-6-one | CAS Registry Number: 82410-32-0
Synonyms: ganciclovir, Cytovene, Vitrasert, Gancyclovir, Hydroxyacyclovir, Citovirax, Cymevene, DHPG, Cymevan, Cymeven, Virgan, HHEMG, Vitrasert (TN), Biolf 62, Cytovene (TN), Ganciclovirum [Latin], nchembio.87-comp3, Prestwick_1068, GANCICLOVIR SODIUM, 2'-Nor-2'-deoxyguanosine

Molecular Formula:	C₉H₁₃N₅O₄	Molecular Weight:	255.230620 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	8

InChIKey: IRSCQMHQWWYFCW-UHFFFAOYSA-N

• Geldanamycin

IUPAC Name: [(3R,5S,6R,7S,8E,10S,11S,12Z,14E)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate | CAS Registry Number: 30562-34-6
Synonyms: geldanamycin, geldanomycin, Geldanamycin (9CI), nchembio.83-comp18, BODIPY-labeled Geldanamycin, BSPBio_001073, NChemBio.2007.10-comp1, CID5288382, IDI1_002122, NCGC00163449-01, NCGC00163449-02, Geldanamycin, Streptomyces hygroscopicus, A00271, C11222, U-29135, 2-Azabicyclo[16.3.1]docosane, geldanamycin deriv., GDM, (4E,6Z,8S,9S,10E,12S,13R,14S,16R)-13-hydroxy-8,14,19-trimethoxy-4,10,12,16-tetramethyl-3,20,22-trioxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18-pentaen-9-yl carbamate, [(3R,5S,6R,7S,8E,10S,11S,12Z,14E)-6-hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-1(21),8,12,14,18-pentaen-10-yl] carbamate, [(3S,5S,6R,7S,8E,10R,11S,12Z,14E)-6-Hydroxy-5,11,21-trimethoxy-3,7,9,15-tetramethyl-16,20,22-trioxo-17-azabicyclo[16.3.1]docosa-8,12,14,18,21-pentaen-10-yl] carbamate
Molecular Formula: C₂₉H₄₀N₂O₉ Molecular Weight: 560.635900 [g/mol]
H-Bond Donor: 3 H-Bond Acceptor: 9

InChIKey: QTQAWLPCGQOSGP-KSRBKZBZSA-N

• Gemfibrozil

IUPAC Name: 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid | CAS Registry Number: 25812-30-0
Synonyms: gemfibrozil, Lopid, Lipur, Decrelip, Trialmin, Bolutol, Lipazil, Litarek, Ausgem, Pilder, Jezil, Apo-Gemfibrozil, Gemfibromax, Gemfibrosil, Renabrazin, Cholespid, Fibratol, Fibrocit, Gemfibril, Gemlipid

Molecular Formula:	C₁₅H₂₂O₃	Molecular Weight:	250.333380 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: HEMJJKBWTPKOJG-UHFFFAOYSA-N

• Geniposide

IUPAC Name: methyl (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate | CAS Registry Number: 24512-63-8
Synonyms: CID107848, ZINC03882101, C09781, 27745-20-6, Cyclopenta(c)pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-, methyl ester, (1S,4aS,7aS)-, Cyclopenta(c)pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-, methyl ester, (1S-(1alpha,4aalpha,7aalpha))-

Molecular Formula:	C₁₇H₂₄O₁₀	Molecular Weight:	388.366460 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	10

InChIKey: IBFYXTRXDNAPMM-BVTMAQQCSA-N

• Genistein

IUPAC Name: 5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one | CAS Registry Number: 446-72-0
Synonyms: genistein, Genisteol, Genisterin, Prunetol, Sophoricol, Genestein, Differenol A, Isoflavone, Bonistein, 4',5,7-Trihydroxyisoflavone, 5,7,4'-Trihydroxyisoflavone, Lactoferrin-genistein, nchembio.76-comp6, Spectrum_000320, Tocris-1110, 1x7r, SpecPlus_000305, Spectrum2_000638, Spectrum3_000678, Spectrum4_001543

Molecular Formula:	C₁₅H₁₀O₅	Molecular Weight:	270.236900 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: TZBJGXHYKVUXJN-UHFFFAOYSA-N

• Gentamycin Sulphate

IUPAC Name: (2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2R,3R,6S)-3-amino-6-[(1R)-1-aminoethyl]oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol; (2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2R,3R,6S)-3-amino-6-(aminomethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol; (2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-diamino-3-[(2R,3R,6S)-3-amino-6-[(1R)-1-(methylamino)ethyl]oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol; sulfuric acid | CAS Registry Number: 1405-41-0
Synonyms: Gentamicine sulfate, Prestwick_240

Molecular Formula:	C₆₀H₁₂₅N₁₅O₂₅S	Molecular Weight:	1488.785000 [g/mol]
H-Bond Donor:	26	H-Bond Acceptor:	40

InChIKey: RDEIXVOBVLKYNT-HDZPSJEVSA-N

• Ginkgolide B

Synonyms: LMPR01040093, C07602

Molecular Formula:	C₂₀H₂₄O₁₀	Molecular Weight:	424.398560 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	10

InChIKey: SQOJOAFXDQDRGF-OOHPMXMZSA-N

• Gliclazide

IUPAC Name: 1-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-(4-methylphenyl)sulfonylurea | CAS Registry Number: 21187-98-4
Synonyms: gliclazide, Glimicron, Diamicron, Nordialex, Glyclazide, Diaikron, Gliklazid, Glimicron (TN), Prestwick_869, Gliclazidum [INN-Latin], Gliclazida [INN-Spanish], Spectrum_001478, SpecPlus_000870, Gliclazide (JAN/INN), Prestwick0_000558, Prestwick1_000558, Prestwick2_000558, Prestwick3_000558, Spectrum3_001862, Spectrum4_000598

Molecular Formula:	C₁₅H₂₁N₃O₃S	Molecular Weight:	323.410540 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: BOVGTQGAOIONJV-UHFFFAOYSA-N

• Glipizide

IUPAC Name: N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-5-methylpyrazine-2-carboxamide | CAS Registry Number: 29094-61-9
Synonyms: glipizide, Glydiazinamide, Glucotrol, Dipazide, Glibenese, Glibetin, Glucolip, Glucozide, Glupitel, Glupizide, Melizide, Metaglip, Minidiab, Minodiab, Napizide, Sucrazide, Glidiab, Mindiab, Minidab, Aldiab

Molecular Formula:	C₂₁H₂₇N₅O₄S	Molecular Weight:	445.535180 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: ZJJXGWJIGJFDTL-UHFFFAOYSA-N

• GLP-1 (7-36 Or 7-37)

IUPAC Name: 9,9-dimethyl-1-(sulfinylamino)decane | CAS Registry Number: 107444-51-9
Synonyms: N-Sulfinyl-t-dodecylamine, Glucagon-like peptide I (7-36), tert-Dodecylamine, N-sulfinyl-, Glp-I (7-36), CID113645, 9,9-Dimethyl-1-(sulfinylamino)decane, 107444-07-5, Glucagon-related peptide 1 (Rana catesbeiana), 3-L-glutamic acid-10-L-valine-16-glycine-17-L-glutamine-23-L-isoleucine-24-L-alanine-27-L-valine-30-L-argininamide-31-de-L-proline-32-de-L-lysine-

Molecular Formula:	C₁₂H₂₅NOS	Molecular Weight:	231.398000 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: XCLBLPLSYOQBEP-UHFFFAOYSA-N

• Glutamic Acid

IUPAC Name: (2S)-2-aminopentanedioic acid | CAS Registry Number: 56-86-0
Synonyms: L-glutamic acid, L-glutamate, glutaminic acid, glutacid, L-Glutaminic acid, GLUTAMIC ACID, glut, Glutamicol, Glutamidex, Glutaminol, Glutaton, Aciglut, Glusate, D-Glutamiensuur, glutamate, Gulutamine, Poly-L-glutamate, (S)-Glutamic acid, L-glu, a-Glutamic acid

Molecular Formula:	C₅H₉NO₄	Molecular Weight:	147.129260 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: WHUUTDBJXJRKMK-VKHMYHEASA-N

• Glyburide (Glibencalmide)

IUPAC Name: 5-chloro-N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxybenzamide | CAS Registry Number: 10238-21-8
Synonyms: glyburide, Glibenclamide, Glybenclamide, Micronase, Diabeta, Neogluconin, Maninil, Daonil, Praeciglucon, Bastiverit, Duraglucon, Gewaglucon, Glibenbeta, Glucohexal, Glucoremed, Hexaglucon, Lisaglucon, Normoglucon, Azuglucon, Benclamin

Molecular Formula:	C₂₃H₂₈ClN₃O₅S	Molecular Weight:	494.003520 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: ZNNLBTZKUZBEKO-UHFFFAOYSA-N

• Gonadorelin

IUPAC Name: N-[1-[[1-[[1-[[1-[[2-[[1-[[1-[2-[(2-amino-2-oxoethyl)carbamoyl]pyrrolidin-1-yl]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide | CAS Registry Number: 33515-09-2
Synonyms: Gonadoliberin, Dirigestran, Fertagyl, Hypocrine, Luliberin, Lutrefact, Relefact, Luforan, Lutamin, Lutal, Relisorm l, GnRH, Luteostimulin, Mammalian GnRH, Cystorelin, GONADORELIN, Kryptocur, Nialutin, Synthetic LRF, Factrel

Molecular Formula:	C₅₅H₇₅N₁₇O₁₃	Molecular Weight:	1182.290100 [g/mol]
H-Bond Donor:	16	H-Bond Acceptor:	19

InChIKey: XLXSAKCOAKORKW-UHFFFAOYSA-N

• Granisetron HCL

IUPAC Name: 1-methyl-N-(9-methyl-9-azabicyclo[3.3.1]nonan-7-yl)indazole-3-carboxamide hydrochloride | CAS Registry Number: 107007-99-8
Synonyms: Kytril, Kytril Injection, Granisetron HCl, Granisetron hydrochloride, Granisetron hydrochloride [USAN], BRL 43694A, C19H27NO3, NSC672814, LS-81436, 1-Methyl-N-(9-methyl-endo-9-azabicyclo(3.3.1)non-3-yl)-1H-indazole-3-carboxamide monohydrochloride, 1H-Indazole-3-carboxamide, 1-methyl-N-(9-methyl-9-azabicyclo(3.3.1)non-3-yl)-, monohydrochloride, endo-, endo-1-Methyl-N-(9-methyl-9-azabicyclo(3.3.1)non-3-yl)-1H-indazole-3-carboxamide hydrochloride, 109889-09-0, 1H-Indazole-3-carboxamide, 1-methyl-N-(9-methyl-9-azabicyclo(3.3.1)non-3-yl)-,monohydrochloride, endo-

Molecular Formula:	C₁₈H₂₅ClN₄O	Molecular Weight:	348.870300 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: QYZRTBKYBJRGJB-UHFFFAOYSA-N

• Griseofulvin

IUPAC Name: (2S,5'R)-7-chloro-3',4,6-trimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione | CAS Registry Number: 126-07-8
Synonyms: griseofulvin, Fulvicin, Amudane, Delmofulvina, Griscofulvin, Griseofulvinum, Grizeofulvin, Fulvistatin, Grisefuline, Grisofulvin, Spirofulvin, Fulvinil, Fungivin, Gresfeed, Grifulin, Grifulvin, Grisactin, Griseomix, Grisetin, Grisovin

Molecular Formula:	C₁₇H₁₇ClO₆	Molecular Weight:	352.766280 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: DDUHZTYCFQRHIY-RBHXEPJQSA-N

• Guanfacine hydrochloride

IUPAC Name: N-(diaminomethylidene)-2-(2,6-dichlorophenyl)acetamide hydrochloride | CAS Registry Number: 29110-48-3
Synonyms: Tenex, Estulic, guanfacine hydrochloride, Connexyn, Intuniv, GUANFACINE HCL, Prestwick_740, GUANFACINE, Tenex (TN), C9H9Cl2N3O.HCl, UNII-PML56A160O, MLS000069745, MLS001077329, MLS002222252, LON 798, EINECS 249-443-3, SPD-503, MolPort-003-666-686, 29110-47-2 (Parent), CID71401

Molecular Formula:	C₉H₁₀Cl₃N₃O	Molecular Weight:	282.554200 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: DGFYECXYGUIODH-UHFFFAOYSA-N

• Haloperidol

IUPAC Name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butan-1-one | CAS Registry Number: 52-86-8
Synonyms: haloperidol, Haldol, Aloperidol, Eukystol, Aloperidin, Aloperidolo, Galoperidol, Halopoidol, Serenelfi, Brotopon, Serenace, Halojust, Serenase, Ulcolind, Uliolind, Vesalium, Halopal, Mixidol, Linton, Pernox

Molecular Formula:	C₂₁H₂₃ClFNO₂	Molecular Weight:	375.864223 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: LNEPOXFFQSENCJ-UHFFFAOYSA-N

• Harpagoside

IUPAC Name: [(1S,4aS,5R,7S,7aS)-4a,5-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] (E)-3-phenylprop-2-enoate | CAS Registry Number: 19210-12-9
Synonyms: Ambap1876, Prestwick3_000988, BSPBio_001055, MLS002154086, BPBio1_001161, MEGxp0_000469, ACon0_000056, ACon1_000134, EINECS 242-881-6, LMPR01020111, CID5281542, NCGC00179325-01, NCGC00179325-02, SMR001233395, AB00513986, C09783, (1S-(1alpha,4aalpha,5alpha,7alpha(E),7aalpha))-1,4a,5,6,7,7a-Hexahydro-4a,5-dihydroxy-7-methyl-7-((allyl-1-oxo-3-phenyl)oxy)cyclopenta(c)pyran-1-yl-beta-D-glucopyranoside

Molecular Formula:	C₂₄H₃₀O₁₁	Molecular Weight:	494.488400 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	11

InChIKey: KVRQGMOSZKPBNS-FMHLWDFHSA-N