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• Cinepazide maleate

IUPAC Name: (Z)-but-2-enedioic acid; (E)-1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one | CAS Registry Number: 26328-04-1
Synonyms: cinepazide maleate, Cinepazide maleate (JAN), CID5282458, D01944

Molecular Formula:	C₂₆H₃₅N₃O₉	Molecular Weight:	533.570800 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	10

InChIKey: XSTJTOKYCAJVMJ-GVTSEVKNSA-N

• Cinnamaldehyde diethyl acetal

IUPAC Name: [(E)-3,3-diethoxyprop-1-enyl]benzene | CAS Registry Number: 7148-78-9
Synonyms: Cinnamaldehyde, diethyl acetal, (3,3-Diethoxy-1-propenyl)benzene, NSC53852, Benzene, (3,3-diethoxy-1-propenyl)-, EINECS 230-467-8, EINECS 246-738-9, NSC 53852, CID5356250, (E)-(3,3-Diethoxy-1-propenyl)benzene, AI3-06442, Benzene, ((1E)-3,3-diethoxy-1-propenyl)-, Benzene, (3,3-diethoxy-1-propenyl)-, (E)-, 25226-98-6

Molecular Formula:	C₁₃H₁₈O₂	Molecular Weight:	206.280820 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: VYKDEWVAUWARRX-ZHACJKMWSA-N

• CINNAMONITRILE, CIS + TRANS, 97%

IUPAC Name: (E)-3-phenylprop-2-enenitrile | CAS Registry Number: 4360-47-8
Synonyms: Cinnamonitrile, Styryl cyanide, Cinnamyl nitrile, beta-Cyanostyrene, 3-Phenylacrylonitrile, trans-Cinnamonitrile, (E)-Cinnamonitrile, .beta.-Cyanostyrene, beta-Phenylacrylonitrile, Cinnamonitrile, (E)-, Acrylonitrile, 3-phenyl-, 1-cyano-2-phenylethene, 3-Phenyl-2-propenenitrile, 1-Cyano-2-phenylethylene, 2-Propenenitrile, 3-phenyl-, (E)3-Phenylacrylonitrile, (E)-3-Phenylacrylonitrile, WLN: NC1U1R, trans-3-Phenylpropenonitrile, C81004_ALDRICH

Molecular Formula:	C₉H₇N	Molecular Weight:	129.158580 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: ZWKNLRXFUTWSOY-QPJJXVBHSA-N

• Cinnamoyl Piperazine

IUPAC Name: 3-phenyl-1-piperazin-1-ylprop-2-en-1-one | CAS Registry Number: 84935-37-5
Synonyms: 1-(cinnamoyl)piperazine, 55486-27-6, AC1L5TFJ, SureCN2909561, CTK5A3701, CTK7G3502, MolPort-008-486-056, AKOS009114929, AG-A-15702, AG-C-70259, KB-86068, KB-152625, 3-phenyl-1-piperazin-1-ylprop-2-en-1-one, 2-Propen-1-one,3-phenyl-1-(1-piperazinyl)-

Molecular Formula:	C₁₃H₁₆N₂O	Molecular Weight:	216.278940 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: DLCYXQODDJUHQL-UHFFFAOYSA-N

• Cinnarizine

IUPAC Name: 1-[di(phenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine | CAS Registry Number: 298-57-7
Synonyms: cinnarizine, Dimitronal, Stutgeron, Dimitron, Folcodal, Midronal, Mitronal, Stugeron, Labyrin, Marisan, Stutgin, Toliman, Glanil, Lazeta, Sepan, Cinarizine, Prestwick_115, nchembio790-comp28, Cinarizina [INN-Spanish], Cinnarizinum [INN-Latin]

Molecular Formula:	C₂₆H₂₈N₂	Molecular Weight:	368.513920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: DERZBLKQOCDDDZ-JLHYYAGUSA-N

• Cinobufagin

Synonyms: Cinobufagine, Cino-bufagin, C1272_SIGMA, NSC90325, CID11969542, 5beta,20(22)-Bufadienolide-3beta,16beta-diol-14,15beta-epoxy 16-acetate, 14,15beta-Epoxy-3beta,16beta-dihydroxy-5beta,20(22)-bufadienolide 16-acetate, 5.beta.-Bufa-20,22-dienolide, 14,15.beta.-epoxy-3.beta.,16.beta.-dihydroxy-, 16-acetate, Bufa-20,22-dienolide, 16-(acetyloxy)-14,15-epoxy-3-hydroxy-, (3.beta.,5.beta.,15.beta.,16.beta.)-

Molecular Formula:	C₂₆H₃₄O₆	Molecular Weight:	442.544560 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: SCULJPGYOQQXTK-OLRINKBESA-N

• Ciprofloxacin

IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid | CAS Registry Number: 85721-33-1
Synonyms: ciprofloxacin, Ciprofloxacina, Ciprobay, Ciproxan, Cipro, Ciprocinol, Cipromycin, Ciproquinol, Bacquinor, Bernoflox, Cifloxin, Ciprodar, Ciproflox, Ciprogis, Ciprolin, Ciprolon, Ciprowin, Ciproxina, Ciproxine, Citopcin

Molecular Formula:	C₁₇H₁₈FN₃O₃	Molecular Weight:	331.341523 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: MYSWGUAQZAJSOK-UHFFFAOYSA-N

• Cis (+) Hydroxy Lactam

IUPAC Name: (2S,3S)-3-hydroxy-2-(4-methoxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one | CAS Registry Number: 42399-49-5
Synonyms: MLS001180963, 475548_ALDRICH, EINECS 255-799-0, ZINC00403210, SMR000475704, ST5405915, AC-509/25001342, 3-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one, (2S-cis)-()-2,3-Dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one, (2S-cis)-2,3-Dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one, 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-, (2S-cis)-

Molecular Formula:	C₁₆H₁₅NO₃S	Molecular Weight:	301.360200 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: LHBHZALHFIQJGJ-CABCVRRESA-N

• Cis Bromobenzoate

IUPAC Name: [(2R,4S)-2-(bromomethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl]methyl benzoate | CAS Registry Number: 61397-56-6
Synonyms: EINECS 262-765-9, CID1390984, BAS 00665648, cis-2-(Bromomethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolane-4-ylmethyl benzoate

Molecular Formula:	C₁₈H₁₅BrCl₂O₄	Molecular Weight:	446.119300 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: OXUPOIXSQGXRGF-KDOFPFPSSA-N

• cis,endo-2-Azabicyclo [3,3,0] octane-3-carboxylic acid benzylester hydrochloride

IUPAC Name: benzyl (2S,3aS,6aS)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole-2-carboxylate;hydrochloride | CAS Registry Number: 87269-87-2
Synonyms: (S,S,S)-Octahydro-cyclopenta[b]pyrrole-2-carboxylic acid benzyl ester HCl, (2S,3aS,6aS)-Benzyl octahydrocyclopenta[b]pyrrole-2-carboxylate hydrochloride, (2S,3aS,6aS)-octahydro-Cyclopenta[b]pyrrole-2-carboxylic acid, Benzyl Ester, HCl, SureCN1997637, 570907_ALDRICH, CTK8B3811, (S,S)-2-Azabicyclo[3,3,0]-octane-3-carboxylic acid benzylester hydrochloride, MolPort-003-937-106, 93779-29-4, ANW-43230, AKOS015895588, AG-H-52156, AK-26502, BR-26502, KB-206593, FT-0602417, FT-0649338, (S,S,S)-2-Azabicyclo[3,3,0]-octane-3-carboxylic acid benzyl ester HCL, (2S,3aS,6aS)-Benzyl octahydrocyclopenta[b]pyrrole-2-carboxylate hydrochloride, (S,S,S)-2-Azabicyclo-[3,3,0]-octane carboxylic acid benzylester hydrochloride

Molecular Formula:	C₁₅H₂₀ClNO₂	Molecular Weight:	281.777800 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: HLXCXOQXUDRJLF-JKBZPBJLSA-N

• cis-1,1,2,2,3,4-Hexafluorocyclobutane

IUPAC Name: (3S,4R)-1,1,2,2,3,4-hexafluorocyclobutane | CAS Registry Number: 22819-47-2
Synonyms: (3R,4S)-1,1,2,2,3,4-hexafluorocyclobutane, PubChem6342, AC1MCSUZ, CTK4F0248, MolPort-001-773-298, PC2838, AKOS006240259, AG-E-65752, (3R,4S)-1,1,2,2,3,4-Hexafluorocyclobutane;, I14-3799, Cyclobutane,1,1,2,2,3,4-hexafluoro-, (3R,4S)-rel-

Molecular Formula:	C₄H₂F₆	Molecular Weight:	164.049099 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	6

InChIKey: LMSLTAIWOIYSGZ-XIXRPRMCSA-N

• cis-1,2-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)stilbene

IUPAC Name: 2-[(E)-1,2-diphenyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane | CAS Registry Number: 151416-94-3
Synonyms: AC1O124L, SCHEMBL6236171, SCHEMBL6236173, AKOS015912085, ZINC195789916, OR10613, FT-0604953, I14-35504, alpha,beta-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)stilbene, 2-[(E)-1,2-diphenyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 2-[1,2-diphenyl-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Molecular Formula:	C₂₆H₃₄B₂O₄	Molecular Weight:	432.174 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: YFLBNMYBKXYNJN-QURGRASLSA-N

• cis-1,4-Dibutyryloxy-2-butene

IUPAC Name: 4-butanoyloxybut-2-enyl butanoate | CAS Registry Number: 144967-77-1
Synonyms: 1,4-Bis(butyryloxy)-2-butene, CIS-1,4-DIBUTYRYLOXY-2-BUTENE, 1572-84-5, ACMC-20ap32, CTK8C6206, 4-butanoyloxybut-2-enyl butanoate, butanoic acid 4-(1-oxobutoxy)but-2-enyl ester, A808303

Molecular Formula:	C₁₂H₂₀O₄	Molecular Weight:	228.284800 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: OGJKSGMVEHGEKF-UHFFFAOYSA-N

• cis-2,6-Dimethylpiperazine

IUPAC Name: (2R,6S)-2,6-dimethylpiperazine | CAS Registry Number: 21655-48-1
Synonyms: (2R,6S)-2,6-dimethylpiperazine, Cis-2,6-dimethyl piperazine, (2S,6R)-2,6-dimethylpiperazine, SBB056139, AG-E-58651, AC1OCT8Q, SureCN63549, 26DMPRZ, AC1Q29PM, KSC491G1R, CTK3J1318, MolPort-001-768-837, 2,6-CIS-DIMETHYL PIPERAZINE, CIS-2,6-DIMETHYL-PIPERAZINE, ANW-24542, AKOS006350052, AM81381, PB23510, AC-19708, AK109502

Molecular Formula:	C₆H₁₄N₂	Molecular Weight:	114.188760 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: IFNWESYYDINUHV-OLQVQODUSA-N

• Cis-3-hexenyl Salicylate

IUPAC Name: [(Z)-hex-3-enyl] 2-hydroxybenzoate | CAS Registry Number: 65405-77-8
Synonyms: cis-3-Hexenyl salicylate, cis-3-HEXENYLSALICYLATE, W509876_ALDRICH, (3Z)-Hex-3-en-1-yl salicylate, NCGC00164233-01, ST5320256, Benzoic acid, 2-hydroxy-, 3-hexenyl ester, (Z)-

Molecular Formula:	C₁₃H₁₆O₃	Molecular Weight:	220.264340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: IEPWIPZLLIOZLU-ARJAWSKDSA-N

• Cisapride

IUPAC Name: 4-amino-5-chloro-N-[1-[3-(4-fluorophenoxy)propyl]-3-methoxypiperidin-4-yl]-2-methoxybenzamide | CAS Registry Number: 81098-60-4
Synonyms: cisapride, Enteropride, Acenalin, Acpulsif, Alipride, Cisapron, Colinorm, Kaudalit, Kinestase, Prepulsid, Pridesia, Propulsid, Propulsin, Syspride, Unipride, Vomiprid, Vomipride, Cipride, Cisawal, Rapulid

Molecular Formula:	C₂₃H₂₉ClFN₃O₄	Molecular Weight:	465.945463 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: DCSUBABJRXZOMT-UHFFFAOYSA-N

• Citalopram hydrobromide

IUPAC Name: 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile hydrobromide | CAS Registry Number: 59729-32-7
Synonyms: citalopram hydrobromide, Celexa, citalopram, Nitalapram, Cipramil, Seropram, Apertia, Elopram, Prisdal, Cipram, Lupram, Sepram, Celexa (TN), C20H21FN2O.HBr, Citalopram hydrobromide [USAN], HSDB 7042, MLS000758293, MLS000860078, MLS001401376, C7861_SIGMA

Molecular Formula:	C₂₀H₂₂BrFN₂O	Molecular Weight:	405.303883 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: WIHMBLDNRMIGDW-UHFFFAOYSA-N

• Citicoline sodium

IUPAC Name: sodium [(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl [oxido-[2-(trimethylazaniumyl)ethoxy]phosphoryl] phosphate | CAS Registry Number: 33818-15-4
Synonyms: CerAxon, CerAxon (TN), CITICOLINE SODIUM, Citicoline sodium salt, IP 302 sodium, Citicoline sodium (USAN), Citicoline sodium [USAN], MLS000028567, EINECS 251-689-1, SMR000058983, D03528, CYTIDINE 5'-DIPHOSPHOCHOLINE SODIUM SALT, Choline hydroxide, 5'-ester with cytidine 5'-(sodium dihydrogen diphosphate), inner salt, Cytidine 5'-(trihydrogen diphosphate), mono(2-(trimethylammonio)ethyl) ester, hydroxide, inner salt, monosodium salt, Cytidine 5'-(trihydrogen diphosphate), P'-(2-(trimethylammonio)ethyl) ester, inner salt, monosodium salt

Molecular Formula:	C₁₄H₂₅N₄NaO₁₁P₂	Molecular Weight:	510.305792 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	12

InChIKey: YWAFNFGRBBBSPD-OCMLZEEQSA-M

• Cladribine

IUPAC Name: (2R,3S,5R)-5-(6-amino-2-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol | CAS Registry Number: 4291-63-8
Synonyms: Leustatin, Chlorodeoxyadenosine, Cladarabine, 2-Chlorodeoxyadenosine, 2-Chloro-2'-deoxyadenosine, Leustatin (TN), 2-CdA, 2 Chlorodeoxyadenosine, 2CdA, 2-Chloro-2'-deoxy-beta-adenosine, MLS000028377, MLS000028484, MLS000759397, MLS001077345, Cladribine (JAN/USAN/INN), Cladribine [USAN:BAN:INN], Cladribine [USAN:INN:BAN], Adenosine, 2-chloro-2'-deoxy, C10H12ClN5O3.C3H8, NSC 105014-F

Molecular Formula:	C₁₀H₁₂ClN₅O₃	Molecular Weight:	285.686980 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	8

InChIKey: PTOAARAWEBMLNO-KVQBGUIXSA-N

• Clarithromycin

IUPAC Name: (2R,3R,4S,5R,8R,9S,10S,11R,12R,14R)-11-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-5-ethyl-3,4-dihydroxy-9-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-12-methoxy-2,4,8,10,12,14-hexamethyl-6-oxacyclotetradecane-1,7-dione | CAS Registry Number: 81103-11-9
Synonyms: clarithromycin, Biaxin, Klaricid, Macladin, Clarith, Klacid, Veclam, Naxy, Clambiotic, Clathromycin, Astromen, Bicrolid, Claribid, Claricide, Heliclar, Klaciped, Mabicrol, Abbotic, Clacine, Cyllind

Molecular Formula:	C₃₈H₆₉NO₁₃	Molecular Weight:	747.953360 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	14

InChIKey: AGOYDEPGAOXOCK-KCBOHYOISA-N

• Clenbuterol Hydrochloride

IUPAC Name: 1-(4-amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethanol hydrochloride | CAS Registry Number: 21898-19-1
Synonyms: Clenbuterol hydrochloride, Spiropent, clenbuterol, Siropent, Spiropent (TN), Prestwick_761, Ambap3657, MLS000069838, MLS001148242, C5423_SIGMA, SPECTRUM1503917, Clenbuterol hydrochloride (JAN), NAB-365, EINECS 256-532-0, EINECS 256-533-6, CID5702273, NCGC00095982-01, LS-30603, SMR000058854, TL8001813

Molecular Formula:	C₁₂H₁₉Cl₃N₂O	Molecular Weight:	313.651060 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	3

InChIKey: OPXKTCUYRHXSBK-UHFFFAOYSA-N

• Climbazole

IUPAC Name: 1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-one | CAS Registry Number: 38083-17-9
Synonyms: Climbazol, Baypival, Baysan, Climbazole [BAN:INN], Climbazol [INN-Spanish], Climbazolum [INN-Latin], 36127_RIEDEL, BAY-E 6975, BAY e-6975, EINECS 253-775-4, MEB-6401, BRN 0618020, NCGC00166153-01, LS-46662, TL8002789, 5-23-04-00209 (Beilstein Handbook Reference), 1-(4-Chlorophenoxy)-1-(imidazol-1-yl)-3,3-dimethylbutanone, 1-(p-Chlorophenoxy)-1-imidazol-1-yl-3,3-dimethyl-2-butanone, 1-(4-Chlorophenoxy)-1-(1H-imidazolyl)-3,3-dimethyl-2-butanone, 1-(p-Chlorophenoxy)-3,3-dimethyl-1-(1-imidazolyl)-2-butanone

Molecular Formula:	C₁₅H₁₇ClN₂O₂	Molecular Weight:	292.760680 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: OWEGWHBOCFMBLP-UHFFFAOYSA-N

• Clindamycin

IUPAC Name: (2S,4R)-N-[2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide | CAS Registry Number: 18323-44-9
Synonyms: clindamycin, Cleocin, Chlolincocin, Clinimycin, Sobelin, Clindamycin Hcl, Chlorlincocin, Dalacin C, 7-Chlorolincomycin, Cleocin HCl, Cleocin (TN), Clindamycine [French], Clindamycin phosphate, Clindamycin hydrochloride, Clindamycine [INN-French], Clindamycinum [INN-Latin], Clindamicina [INN-Spanish], 7-CDL, 7-Chloro-7-deoxylincomycin, Clindamycin (USAN/INN)

Molecular Formula:	C₁₈H₃₃ClN₂O₅S	Molecular Weight:	424.983020 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: KDLRVYVGXIQJDK-NOWPCOIGSA-N

• Clindamycin hydrochloride

IUPAC Name: (2S,4R)-N-[(1S,2S)-2-chloro-1-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-1-methyl-4-propylpyrrolidine-2-carboxamide hydrochloride | CAS Registry Number: 21462-39-5
Synonyms: Prestwick_69, MLS000069765, CID6419884, SMR000058902

Molecular Formula:	C₁₈H₃₄Cl₂N₂O₅S	Molecular Weight:	461.443960 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	6

InChIKey: AUODDLQVRAJAJM-PTTDBYGSSA-N

• Clindamycin palmitate

IUPAC Name: [(2R,3R,4S,5R,6R)-6-[(1S,2S)-2-chloro-1-[[(2S,4R)-1-methyl-4-propylpyrrolidine-2-carbonyl]amino]propyl]-4,5-dihydroxy-2-methylsulfanyloxan-3-yl] hexadecanoate | CAS Registry Number: 36688-78-5
Synonyms: UNII-C501Z28AFG, C34H63ClN2O6S, C501Z28AFG, LS-174616, L-threo-alpha-D-Galacto-octopyranoside, 4-propyl-2-pyrrolidinyl)carbonyl)amino)-1-thio-2-hexadecanoate, (2S-trans)-, Methyl 7-chloro-6,7,8-trideoxy-6-(((1-methyl-methyl 7-chloro-6,7,8-trideoxy-6-(1-methyl-trans-4-propyl-l-2-pyrrolidinecarboxamido)-1-thio-l-threo-alpha-D-galacto-octopyranoside 2-palmitate

Molecular Formula:	C₃₄H₆₃ClN₂O₆S	Molecular Weight:	663.391820 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	8

InChIKey: OYSKUZDIHNKWLV-PRUAPSLNSA-N

• Clinofibrate

IUPAC Name: 2-[4-[1-[4-(1-hydroxy-2-methyl-1-oxobutan-2-yl)oxyphenyl]cyclohexyl]phenoxy]-2-methylbutanoic acid | CAS Registry Number: 30299-08-2
Synonyms: clinofibrate, Lipoclin, Lipoclin (TN), Clinofibrate [INN:JAN], Clinofibratum [INN-Latin], Clinofibrato [INN-Spanish], Clinofibrate (JP15/INN), CID2787, C28H36O6, BRN 2230067, NCGC00167453-01, LS-47934, S 8527, D01300, S-8527, 2,2'-(4,4'-Cyclohexylidenediphenoxy)-2,2'-dimethyldibutyric acid, 2,2'-(Cyclohexylidenebis(4,1-phenyleneoxy))bis(2-methylbutanoic acid), 2,2'-(Cyclohexylidenebis(p-phenyleneoxy))bis(2-methylbutyric acid), 2,2'-Cyclohexane-1,1-diylbis(p-phenyleneoxy)bis(2-methylbutyric acid), 1,1-bis(4'-(1''-carboxy-1''-methylpropoxy)phenyl)cyclohexane

Molecular Formula:	C₂₈H₃₆O₆	Molecular Weight:	468.581840 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: BMOVQUBVGICXQN-UHFFFAOYSA-N

• Clofop

IUPAC Name: 2-[4-(4-chlorophenoxy)phenoxy]propanoic acid | CAS Registry Number: 26129-32-8
Synonyms: Fenofibric acid, Clofop [ISO], fenofibric acid sodium salt, HCG 004, HCG-004, C15H13ClO4, fenofibric acid, (R)-isomer, fenofibric acid potassium salt, HOE 19453, LF 479, CID64928, BRN 1996227, HOE-19453, LF-479, NSC326777, 2-(4-(4-Chlorophenoxy)phenoxy)propanoic acid, 2-(4-(4-Chlorophenoxy)phenoxy)propionic acid, 2-(4-(4'-chlorophenoxy)phenoxy)propionic acid, LS-124590, TL8002090

Molecular Formula:	C₁₅H₁₃ClO₄	Molecular Weight:	292.714320 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: BSFAVVHPEZCASB-UHFFFAOYSA-N

• Clomiphene citrate

IUPAC Name: 2-[4-[(E)-2-chloro-1,2-di(phenyl)ethenyl]phenoxy]-N,N-diethylethanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid | CAS Registry Number: 50-41-9
Synonyms: Serophene, Clomid, Clomifene citrate, Serophene (TN), Enclomiphene citrate, Prestwick_757, Clomid (TN), CLOMIPHENE CITRATE, trans-Clomifene citrate, trans-Clomiphene citrate, Clomiphene citrate (USP), Clomiphene citrate (Z,E), C26H28ClNO, Clomifene citrate (JP15), MLS000069760, (E)-isomer, citrate (1:1), SMR000058740, LS-157238, D00962, Triethylamine, 2-(p-(2-chloro-1,2-diphenylvinyl)phenoxy)-, citrate, (E)-

Molecular Formula:	C₃₂H₃₆ClNO₈	Molecular Weight:	598.083140 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	9

InChIKey: PYTMYKVIJXPNBD-BTKVJIOYSA-N

• Clomipramine

IUPAC Name: 3-(9-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine | CAS Registry Number: 303-49-1
Synonyms: clomipramine, Chlorimipramine, Monochlorimipramine, Anafranil base, 3-Chloroimipramine, Hydiphen, Anafranil, Chlomipramine, Clomipraminum, Clomipramina, Clomicalm, Anafranil (free base), Clomipramine HCL, Anafranil (TN), Clomipramine (INN), Clomipraminum [INN-Latin], Clomipramina [INN-Spanish], Spectrum_000444, Tocris-0457, Clomipramine hydrochloride

Molecular Formula:	C₁₉H₂₃ClN₂	Molecular Weight:	314.852320 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: GDLIGKIOYRNHDA-UHFFFAOYSA-N

• Clopidogrel

IUPAC Name: methyl (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate | CAS Registry Number: 113665-84-2
Synonyms: clopidogrel, Plavix, (+)-Clopidogrel, Clopidogrel (TN), Clopidogrel (INN), Plavix (TN), Spectrum_000105, Clopidogrel [BAN:INN], Clopidogrel [INN:BAN], Spectrum2_000512, Spectrum3_001606, Spectrum4_000175, CLOPIDOGREL SULFATE, C16H16ClNO2S, BSPBio_003211, KBioGR_000689, KBioSS_000545, MLS001165708, MLS001195633, MLS001304711

Molecular Formula:	C₁₆H₁₆ClNO₂S	Molecular Weight:	321.821740 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: GKTWGGQPFAXNFI-HNNXBMFYSA-N

• Clopidol

IUPAC Name: 3,5-dichloro-2,6-dimethyl-1H-pyridin-4-one | CAS Registry Number: 2971-90-6
Synonyms: Metichlorpindol, Meticlorpindol, Coyden, Coccidiostat C, Methylchlorpindol, Pharmcoccide, Clopindol, Lerbek, Methylchloropindol, Coyden 25, Clopidolo [DCIT], Rigekokcin (rigecoccin), Caswell No. 306AA, Clopidolum [INN-Latin], Clopidol (USAN/INN), C7H7Cl2NO, Spectrum2_000018, Spectrum3_001952, BSPBio_003552, Clopidol [USAN:BAN:INN]

Molecular Formula:	C₇H₇Cl₂NO	Molecular Weight:	192.042580 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: ZDPIZLCVJAAHHR-UHFFFAOYSA-N

• Clorprenaline

IUPAC Name: 1-(2-chlorophenyl)-2-(propan-2-ylamino)ethanol hydrochloride | CAS Registry Number: 3811-25-4
Synonyms: Isoprophenamine, Isoprophenamine (VAN), clorprenaline hydrochloride, USAF EL-50, Isoprophenamine hydrochloride, C11H16ClNO.HCl, Clorprenaline (anhydrous), Clorprenaline hydrochloride anhydrous, EINECS 230-058-4, NSC 334693, WLN: GR BYQ1MY1&1 &GH, NSC334693, LS-42777, N-Isopropyl-2-hydroxy-2-(o-chlorophenyl)ethylamine hydrochloride, (+-)-1-o-Chlorophenyl-2-isopropylaminoethanol hydrochloride, 2-Chloro-alpha-((isopropylamino)methyl)benzyl alcohol hydrochloride, Benzyl alcohol, o-chloro-alpha-((isopropylamino)methyl)-, hydrochloride, 6933-90-0, Benzyl alcohol, o-chloro-.alpha.-[(isopropylamino)methyl]-, hydrochloride, Benzenemethanol, 2-chloro-.alpha.-[[(1-methylethyl)amino]methyl]-, hydrochloride

Molecular Formula:	C₁₁H₁₇Cl₂NO	Molecular Weight:	250.164780 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	2

InChIKey: CPCPUCRSKRHVAH-UHFFFAOYSA-N

• Clorsulon

IUPAC Name: 4-amino-6-(1,2,2-trichloroethenyl)benzene-1,3-disulfonamide | CAS Registry Number: 60200-06-8
Synonyms: Curatrem, CLORSULON, Ivomec-F, Mixture Name, Clorsulon [Spanish], Clorsulone [French], Clorsulonum [Latin], Curatrem (TN), Clorsulon (USAN/INN), Prestwick0_000540, Prestwick1_000540, Prestwick2_000540, Prestwick3_000540, Clorsulon [USAN:BAN:INN], C8H8Cl3N3O4S2, BSPBio_000559, BSPBio_002432, MLS002153866, SPECTRUM1505115, SPBio_002480

Molecular Formula:	C₈H₈Cl₃N₃O₄S₂	Molecular Weight:	380.655820 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: QOVTVIYTBRHADL-UHFFFAOYSA-N

• Closantel Sodium

IUPAC Name: sodium 2-[[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylphenyl]carbamoyl]-1-hydroxy-4,6-diiodocyclohexa-2,4-diene-1-carboxylate | CAS Registry Number: 61438-64-0
Synonyms: EINECS 262-794-7, CID6454197, Sodium N-(5-chloro-4-((4-chlorophenyl)cyanomethyl)-o-tolyl)-2-hydroxy-3,5-diiodobenzamidate

Molecular Formula:	C₂₃H₁₅Cl₂I₂N₂NaO₄	Molecular Weight:	731.080910 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: RXSIDIGYVIIPJX-UHFFFAOYSA-M

• Colcemid

IUPAC Name: 1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one | CAS Registry Number: 477-30-5
Synonyms: Demecolcine, colcemid, Colchamine, Demecolcin, Desmecolcine, Kolchamin, Kolkamin, Omaine, Methylcolchicine, Omain, Substance F, Reichstein's F, (-)-Demecolcine, (-)-Colchamine, Kolchicin [Czech], Santavy's substance F, Deacetylmethylcolchicine, Desacetylmethylcolchicine, N-Desacetylmethylcolchicine, Demecolcinum [INN-Latin]

Molecular Formula:	C₂₁H₂₅NO₅	Molecular Weight:	371.426900 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: NNJPGOLRFBJNIW-UHFFFAOYSA-N

• Colestipol Hydrochloride

IUPAC Name: N'-(2-aminoethyl)-N-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine hydrochloride | CAS Registry Number: 37296-80-3
Synonyms: Cholestabyl, Colestid, Lestid, Flavored Colestid, Colestipol hydrochloride, TEPA, Colestipol hydrochloride [USAN], T2033_SIGMA, C60H114O8.HCl, 375683_ALDRICH, U-26597A, CID3084661, Tetraethylenepentamine pentahydrochloride, LS-54700, Copolymer of diethylenetriamine and 1-chloro-2,3-epoxypropane, hydrochloride (with approximately 1 out of 5 amine nitrogens protonated)

Molecular Formula:	C₈H₂₄ClN₅	Molecular Weight:	225.762660 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	5

InChIKey: GACQNVJDWUAPFY-UHFFFAOYSA-N

• Copper Stearate

IUPAC Name: copper octadecanoate | CAS Registry Number: 660-60-6
Synonyms: Cupric stearate, Kupfer(II) stearat, COPPER STEARATE, Copper distearate, pure, Stearic acid, copper salt, EINECS 211-540-3, EINECS 231-527-6, Octadecanoic acid, copper(2+) salt, AI3-00903, LS-192172, 7617-31-4

Molecular Formula:	C₃₆H₇₀CuO₄	Molecular Weight:	630.484600 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: PEVZEFCZINKUCG-UHFFFAOYSA-L

• Copper, bis[1-(hydroxy-kO)-2(1H)-pyridinethionato-kS2]-

IUPAC Name: copper;1-hydroxypyridine-2-thione | CAS Registry Number: 17652-46-9
Synonyms: Copper pyrithione, 154592-20-8, cupper(ii)pyrithione, C10H8N2O2S2Cu, Copper 2-pyridinethiol-1-oxide, MolPort-023-220-315, AKOS015909412, ING0003992, copper pyrithione(cupt, copper omadine), bis(2-thioxopyridin-1(2H)-yloxy)copper, I428, FT-0659258, K-4881, 915C378, copper pyrithione, copper 2-pyridinethiol-1-oxide, I14-33800, 2,2\'-spirobi[[1,4,2]oxathiazolo[2,3-a]pyridin-4-ium]

Molecular Formula:	C₁₀H₁₀CuN₂O₂S₂	Molecular Weight:	317.868 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: QHNCWVQDOPICKC-UHFFFAOYSA-N

• Costunolide

IUPAC Name: (3aS,6E,10E,11aR)-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one | CAS Registry Number: 553-21-9
Synonyms: STOCK1N-49769, AIDS059915, AIDS-059915, NSC106404, CID5281437, C09382, Cyclodeca[b]furan-2(3H)-one, 3a,4,5,8,9,11a-hexahydro-6,10-dimethyl-3-methylene-, (3aS,6E,10E,11aR)-

Molecular Formula:	C₁₅H₂₀O₂	Molecular Weight:	232.318100 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: HRYLQFBHBWLLLL-AHNJNIBGSA-N

• CP-380736

IUPAC Name: 6,7-bis(2-methoxyethoxy)-1H-quinazolin-4-one | CAS Registry Number: 179688-29-0
Synonyms: 6,7-Bis-(2-methoxyethoxy)-4(3H)-quinazolinone, 6,7-BIS(2-METHOXYETHOXY)QUINAZOLIN-4(3H)-ONE, AG-E-29986, 6,7-Bis(2-methoxyethoxy)-4(3H)-quinazolinone, 6,7-BIS(2-METHOXYETHOXY)QUINAZOLIN-4-OL, 6,7-bis-(2-Methoxyethoxy)-quinazolin-4(3h)-one, 6,7-Bis(2-methoxyethoxy)-3,4-dihydroquinazolin-4-one, ZINC04302043, AC1MDC7V, SureCN263796, SureCN263797, SureCN471137, KSC174K2R, CTK0H4528, CTK7B3690, MolPort-002-899-666, HMS1662H06, HMS3260F19, ACN-S002007, ANW-60710

Molecular Formula:	C₁₄H₁₈N₂O₅	Molecular Weight:	294.303120 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: PMQWTUWLIGJTQD-UHFFFAOYSA-N

• CPK (CAS: 9001-15-4)

• Creatine

IUPAC Name: 2-[carbamimidoyl(methyl)amino]acetic acid | CAS Registry Number: 57-00-1
Synonyms: creatine, N-amidinosarcosine, Creatin, Kreatin, Krebiozon, methylglycocyamine, Creatine, hydrate, Pyrolysate, N-methyl-N-guanylglycine, Creatine (8CI), Methylguanidoacetic acid, (alpha-Methylguanido)acetic acid, methylguanidinoacetic acid, alpha-Methylguanidino acetic acid, C0780_SIGMA, NSC8752, N-carbamimidoyl-N-methylglycine, 291196_ALDRICH, CID586, Glycine, N-(aminoiminomethyl)-N-methyl-

Molecular Formula:	C₄H₉N₃O₂	Molecular Weight:	131.133160 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: CVSVTCORWBXHQV-UHFFFAOYSA-N

• Croconazole hydrochloride

IUPAC Name: 1-[1-[2-[(3-chlorophenyl)methoxy]phenyl]ethenyl]imidazole hydrochloride | CAS Registry Number: 77174-66-4
Synonyms: Pilzcin, croconazole hydrochloride, Pilzcin (TN), Cloconazole hydrochloride, Cloconazole monohydrochloride, Cloconazol clorhidrato [Spanish], Croconazol clorhidrato [Spanish], Croconazole Hydrochloride [JAN], Croconazole hydrochloride (JP15), LS-78270, 710674-S, D02169, 710674S, 1-(1-O-(m-(Chlorobenzyloxy)phenyl)vinyl)-1H-imidazole hydrochloride, 1-(1-(2-((3-Chlorobenzyl)oxy)phenyl)vinyl)-1H-imidazole hydrochloride, 1-(1-(2-((3-Chlorophenyl)methoxy)phenyl)ethenyl)-1H-imidazole hydrochloride, 1-(1-(2-((3-Clorobenzil)oxi)fenil)vinil)-1H-imidazol monoclorhidrato [Spanish], 1-(1-(2-((3-Clorofenil)metoxi)fenil)etenil)-1H-imidazol monoclorhidrato [Spanish], 1H-Imidazole, 1-(1-(2-((3-chlorobenzyl)oxy)phenyl)vinyl)-, monohydrochloride, 1H-Imidazole, 1-(1-(2-((3-chlorophenyl)methoxy)phenyl)ethenyl)-, monohydrochloride

Molecular Formula:	C₁₈H₁₆Cl₂N₂O	Molecular Weight:	347.238440 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: LWJUIYYIILPRRI-UHFFFAOYSA-N

• Crotamiton

IUPAC Name: (E)-N-ethyl-N-(2-methylphenyl)but-2-enamide | CAS Registry Number: 483-63-6
Synonyms: crotamiton, Eurax, Crotamitone, Crotalgin, Veteusan, Eurasil, Euraxil, Crotan, Caswell No. 431B, Eurax (TN), N-Ethyl-o-crotonotoluidide, Crotamitonum [INN-Latin], Prestwick2_000951, Prestwick3_000951, Crotonyl-N-ethyl-o-toluidine, BSPBio_000942, BSPBio_002722, Crotamiton (JAN/USP/INN), Crotamiton [BAN:INN:JAN], Crotamiton [INN:BAN:JAN]

Molecular Formula:	C₁₃H₁₇NO	Molecular Weight:	203.280180 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: DNTGGZPQPQTDQF-XBXARRHUSA-N

• Crotonoyl chloride

IUPAC Name: (E)-but-2-enoyl chloride | CAS Registry Number: 10487-71-5
Synonyms: 2-Butenoyl chloride, Crotonyl chloride, sGQHDHaImfXIh, 2-Crotonoyl chloride, Crotonoyl chloride (E)-, (E)-CH3CH=CHCOCl, 2-Butenoyl chloride, (E)-, (2E)-but-2-enoyl chloride, 2-butenoyl chloride, (2E)-, 127787_ALDRICH, 28051_FLUKA, MolPort-001-793-407, EINECS 210-889-9, EINECS 234-010-3, CID643131, ZINC02242606, TL8004173, C0424, I14-4796, InChI=1/C4H5ClO/c1-2-3-4(5)6/h2-3H,1H3/b3-2

Molecular Formula:	C₄H₅ClO	Molecular Weight:	104.534900 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: RJUIDDKTATZJFE-NSCUHMNNSA-N

• CROTYL ALCOHOL

IUPAC Name: (E)-but-2-en-1-ol | CAS Registry Number: 504-61-0
Synonyms: Crotonyl alcohol, Crotyl alcohol, 2-Buten-1-ol, Krotylalkohol, 2-Butenol, 2-Butenyl alcohol, 3-Methylallyl alcohol, Krotylalkohol [Czech], trans-Crotonyl Alcohol, Crotyl alcohol (VAN), Crotonyl alcohol (VAN), 2-Buten-1-ol, (E)-, 2-BUTENE-1-OL, (E)-2-Buten-1-ol, (E)-But-2-en-1-ol, 2-Buten-1-ol, (2E)-, (2E)-but-2-en-1-ol, C86006_ALDRICH, 28091_FLUKA, EINECS 228-086-7

Molecular Formula:	C₄H₈O	Molecular Weight:	72.105720 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: WCASXYBKJHWFMY-NSCUHMNNSA-N

• Crustecdysone

IUPAC Name: (2S,3R,5R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-17-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one | CAS Registry Number: 5289-74-7
Synonyms: Ecdysterone, beta-Ecdysone, Polypodine A, Isoinokosterone, Viticosterone, Commisterone, Crustecdyson, Ecdysteron, 20-HYDROXYECDYSONE, 20-OH ecdysone, ECDYSONE, Insect moulting hormone, THE-7, MLS001164644, H5142_SIGMA, CHEBI:16587, AIDS013374, AIDS-013374, NSC629484, ZINC04165898

Molecular Formula:	C₂₇H₄₄O₇	Molecular Weight:	480.634060 [g/mol]
H-Bond Donor:	6	H-Bond Acceptor:	7

InChIKey: NKDFYOWSKOHCCO-YPVLXUMRSA-N

• Cryptotanshinone

IUPAC Name: (1R)-1,6,6-trimethyl-2,3a,7,8,9,11a-hexahydro-1H-naphtho[1,2-g][1]benzofuran-10,11-dione | CAS Registry Number: 35825-57-1
Synonyms: (1R)-1,6,6-trimethyl-1,2,3a,6,7,8,9,11a-octahydrophenanthro[1,2-b]furan-10,11-dione

Molecular Formula:	C₁₉H₂₂O₃	Molecular Weight:	298.376180 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: IJSBKZLSTIFYIE-FPKDZHNTSA-N

• Cyclic somatostatin

Synonyms: SOMATOSTATIN, AIDS059774, AIDS-059774

Molecular Formula:	C₆₇H₉₅N₁₇O₁₈S₂	Molecular Weight:	1490.704300 [g/mol]
H-Bond Donor:	21	H-Bond Acceptor:	22

InChIKey: IVXKQLNIZABQDV-DOBXHNDVSA-N

• Cyclohexyl Chloroformate

IUPAC Name: cyclohexyl carbonochloridate | CAS Registry Number: 13248-54-9
Synonyms: Cyclohexyl chloroformate, EINECS 236-230-5, Carbonochloridic acid, cyclohexyl ester

Molecular Formula:	C₇H₁₁ClO₂	Molecular Weight:	162.614040 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: IWVJLGPDBXCTDA-UHFFFAOYSA-N