Zhejiang Unipharma-Chem Co., Ltd., Zhejiang, China @ ChemicalRegister.com

Zhejiang Unipharma-Chem Co., Ltd.

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Profile: Zhejiang Unipharma-Chem Co., Ltd. specializes in marketing & manufacturing of pharmaceutical intermediates, bulk drugs and fine chemicals. Active pharmaceutical ingredients include atropine sulphate, baclofen, formoterol fumarate, finasteride, milnacipran HCl, tenoxicam, trospium chloride and meropenem. We also offer food additives include choline chloride, betaine HCL and sucralose (trichlorosucrose).

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• alpha-[[[(2-Furanylcarbonyl)amino]carbonyl]amino]benzeneacetic acid

IUPAC Name: 2-(furan-2-carbonylcarbamoylamino)-2-phenylacetic acid | CAS Registry Number: 89307-25-5
Synonyms: Benzeneacetic acid, a-[[[(2-furanylcarbonyl)amino]carbonyl]amino]-, |A-[[[(2-Furanylcarbonyl)amino]carbonyl]amino] benzeneacetic acid, ACMC-20lklk, CTK5G2819, MolPort-005-932-926, SBB066261, AKOS015896162, AG-H-61510, Q012, FT-0656902, A843126, I06-1669, 2-(furan-2-ylcarbonylcarbamoylamino)-2-phenyl-ethanoic acid, 2-[[[[2-furanyl(oxo)methyl]amino]-oxomethyl]amino]-2-phenylacetic acid

Molecular Formula:	C₁₄H₁₂N₂O₅	Molecular Weight:	288.255480 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: OHBHOADQJUEVFG-UHFFFAOYSA-N

• Anti radon

IUPAC Name: 2-aminoethyl carbamimidothioate dihydrobromide | CAS Registry Number: 56-10-0
Synonyms: Antiradon, Surrectan, Antirad, Ixecur, USAF XR-31, A5879_SIGMA, SPECTRUM1505119, 2-Aminoethylisothiouronium dibromide, EINECS 200-257-0, A. E. T, NSC 22877, 2-Aminoethylisothiuronium dihydrobromide, A. E. T., S-(2-Aminoethyl)isothiuronium dibromide, 2-Aminoethylthiopseudourea dihydrobromide, S-beta-Aminoethylisothiuronium bromohydrate, 2-(2-Aminoethyl)isothiourea dihydrobromide, AI3-23427, Aminoethylisothiuronium bromide hydrobromide, NCGC00093585-01

Molecular Formula:	C₃H₁₁Br₂N₃S	Molecular Weight:	281.012540 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: XDVMCVGTDUKDHL-UHFFFAOYSA-N

• b-Ketoglutaric Acid

IUPAC Name: 3-oxopentanedioic acid | CAS Registry Number: 542-05-2
Synonyms: 3-Oxoglutaric acid, Acetonedicarboxylic acid, Ambap5850, Pentanedioic acid, 3-oxo-, 1,3-Acetonedicarboxylic acid, 165115_ALDRICH, EINECS 208-797-9, K-2480

Molecular Formula:	C₅H₆O₅	Molecular Weight:	146.098140 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: OXTNCQMOKLOUAM-UHFFFAOYSA-N

• Benzo[b]thiophene

IUPAC Name: 1-benzothiophene | CAS Registry Number: 95-15-8
Synonyms: 1-Benzothiophene, Benzothiofuran, Thianaphthene, Thionaphthene, Benzothiophen, Thianaphtene, Thianaphthen, 1-Thiaindene, BENZOTHIOPHENE, 2,3-Benzothiophene, BENZO(B)THIOPHENE, Benzothiophene (VAN), T27405_ALDRICH, 357790_ALDRICH, 12808_FLUKA, CHEBI:35858, NSC47196, EINECS 202-395-7, NSC 47196, STK053859

Molecular Formula:	C₈H₆S	Molecular Weight:	134.198240 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: FCEHBMOGCRZNNI-UHFFFAOYSA-N

• Betaine Base, Anhydrous

IUPAC Name: 2-(trimethylazaniumyl)acetate | CAS Registry Number: 107-43-7
Synonyms: betaine, glycine betaine, oxyneurine, lycine, Abromine, Glycylbetaine, Trimethylglycine, Trimethylglycocoll, Jortaine, acidin-pepsin, Glycocoll betaine, alpha-Earleine, Cystadane, Rubrine C, Aminocoat, Greenstim, Betafin, FinnStim, Loramine AMB 13, Betaine solution

Molecular Formula:	C₅H₁₁NO₂	Molecular Weight:	117.146340 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: KWIUHFFTVRNATP-UHFFFAOYSA-N

• Betaine Hydrochloride

IUPAC Name: carboxymethyl(trimethyl)azanium chloride | CAS Registry Number: 590-46-5
Synonyms: Betaine hydrochloride, Betaine chloride, Acidogeno, Acipepsol, Pluchine, Achylin, Acinorm, Acidin, Acidol, Acidol-Pepsin, Aciventral forte, Cystadane, Cystdane, Mixture Name, ACIDINE, Acidol hydrochloride, Cystdane (TN), Lycine hydrochloride, Rubrine C hydrochloride, component of Normacid

Molecular Formula:	C₅H₁₂ClNO₂	Molecular Weight:	153.607280 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: HOPSCVCBEOCPJZ-UHFFFAOYSA-N

• Bicalutamide

IUPAC Name: (2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenyl)sulfonyl-2-hydroxy-2-methylpropanamide | CAS Registry Number: 90357-06-5
Synonyms: bicalutamide, Casodex, (R)-Bicalutamide, R-BICALUTAMIDE, Bicalutamide [USAN:BAN:INN], CHEBI:3090, STOCK6S-47735, 1z95, CID56069, DB01128, DB02932, ICI 176334, BRN 5364666, NCGC00167487-01, (2R)-N-[4-CYANO-3-(TRIFLUOROMETHYL)PHENYL]-3-[(4-FLUOROPHENYL)SULFONYL]-2-HYDROXY-2-METHYLPROPANAMIDE, (+-)-4'-Cyano-alpha,alpha,alpha-trifluoro-3-((p-fluorophenyl)sulfonyl)-2-methyl-m-lactotoluidide, (2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenyl)sulfonyl-2-hydroxy-2-methylpropanamide, Propanamide, N-(4-cyano-3-(trifluoromethyl)phenyl)-3-((4-fluorophenyl)sulfonyl)-2-hydroxy-2-methyl-, (+-)-

Molecular Formula:	C₁₈H₁₄F₄N₂O₄S	Molecular Weight:	430.373373 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	9

InChIKey: LKJPYSCBVHEWIU-KRWDZBQOSA-N

• Choline Chloride

IUPAC Name: 2-hydroxyethyl(trimethyl)azanium chloride | CAS Registry Number: 67-48-1
Synonyms: Hepacholine, Biocolina, Biocoline, Hormocline, Neocolina, Lipotril, Paresan, Luridin chloride, CHOLINE CHLORIDE, Cholinium chloride, Choline, chloride, Bilineurin chloride, Choline hydrochloride, Choline chlorhydrate, Chloride de choline, CHOLINE (CL), Colina cloruro [DCIT], Choline chloride [INN], Choline chloride solutions, Chloride de choline [French]

Molecular Formula:	C₅H₁₄ClNO	Molecular Weight:	139.623760 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: SGMZJAMFUVOLNK-UHFFFAOYSA-M

• Di Sodium Chromoglycate

IUPAC Name: disodium 5-[3-(2-carboxylato-4-oxochromen-5-yl)oxy-2-hydroxypropoxy]-4-oxochromene-2-carboxylate | CAS Registry Number: 15826-37-6
Synonyms: Gastrocrom, Intal, Frenasma, Nasalcrom, Nebulasma, Opticrom, Rynacrom, Aararre, Lomudal, Lomudas, Lomusol, Nalcrom, Aarane, Lomuda, Nasmil, Sodium cromolyn, Chromolyn sodium, sodium cromoglicate, Cromoglycate, Gastrofrenal

Molecular Formula:	C₂₃H₁₄Na₂O₁₁	Molecular Weight:	512.330200 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	11

InChIKey: VLARUOGDXDTHEH-UHFFFAOYSA-L

• Dibenzothiophene

IUPAC Name: dibenzothiophene | CAS Registry Number: 132-65-0
Synonyms: dibenzothiophene, Diphenylene sulfide, 9-Thiafluorene, alpha-Thiafluorene, Dibenzo[b,d]thiophene, Dibenzo(b,d)thiophene, .alpha.-Thiafluorene, Dibenzothiophene [USAN], 2,2'-Biphenylylene sulfide, Spectrum_000926, Dibenzothiophene (USAN), Spectrum2_001011, Spectrum3_000383, Spectrum4_000504, Spectrum5_000863, CCRIS 5307, BSPBio_002165, D32202_ALDRICH, KBioGR_001047, KBioSS_001406

Molecular Formula:	C₁₂H₈S	Molecular Weight:	184.256920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: IYYZUPMFVPLQIF-UHFFFAOYSA-N

• Ethyl isocyanoacetate

IUPAC Name: ethyl 2-isocyanoacetate | CAS Registry Number: 2999-46-4
Synonyms: 226319_ALDRICH, 58822_FLUKA, EINECS 221-077-9, InChI=1/C5H7NO2/c1-3-8-5(7)4-6-2/h3-4H2,1H

Molecular Formula:	C₅H₇NO₂	Molecular Weight:	113.114580 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: FPULFENIJDPZBX-UHFFFAOYSA-N

• Formoterol

IUPAC Name: N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide | CAS Registry Number: 73573-87-2
Synonyms: formoterol, FORMOTEROL FUMARATE, Formoterolum [INN-Latin], Formoterol [USAN:INN], HSDB 7287, CID3410, DB00983, NCGC00181126-01, C07805, N-[2-hydroxy-5-[1-hydroxy-2-[1-(4-methoxyphenyl)propan-2-ylamino]ethyl]phenyl]formamide, (+-)-2'-Hydroxy-5'-((RS)-1-hydroxy-2-(((RS)-p-methoxy-alpha-methylphenethyl)amino)ethyl)formanilide

Molecular Formula:	C₁₉H₂₄N₂O₄	Molecular Weight:	344.404860 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	5

InChIKey: BPZSYCZIITTYBL-UHFFFAOYSA-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

• Ipratropium Bromide

IUPAC Name: [(1S,5R)-8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate bromide | CAS Registry Number: 22254-24-6
Synonyms: ipratropium bromide, Prestwick_279, Ipratropium bromide anhydrous, MLS000069557, CHEBI:46659, SMR000058764, (3-endo,8-syn)-3-[(3-hydroxy-2-phenylpropanoyl)oxy]-8-isopropyl-8-methyl-8-azoniabicyclo[3.2.1]octane bromide

Molecular Formula:	C₂₀H₃₀BrNO₃	Molecular Weight:	412.361100 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: LHLMOSXCXGLMMN-CLTUNHJMSA-M

• Meldrum's Acid

IUPAC Name: 2,2-dimethyl-1,3-dioxane-4,6-dione | CAS Registry Number: 2033-24-1
Synonyms: Meldrum's acid, Isopropylidene malonate, 2,2-Dimethyl-1,3-dioxane-4,6-dione, cycl-Isopropylidene malonate, 1,3-Dioxane-4,6-dione, 2,2-dimethyl-, Cyclic isopropylidene malonate, 2,2-Dimethyl-4,6-dioxo-m-dioxane, 2,2-Dimethyl-m-dioxane-4,6-dione, 210145_ALDRICH, Malonic acid, cyclic isopropylidene ester, EINECS 217-992-8, NSC 71902, NSC688343, AIDS150666, AIDS-150666, NSC71902, BRN 0117310, ZINC01697324, m-DIOXANE-4,6-DIONE, 2,2-DIMETHYL-, AI3-39039

Molecular Formula:	C₆H₈O₄	Molecular Weight:	144.125320 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: GXHFUVWIGNLZSC-UHFFFAOYSA-N

• Methanesulfinic Acid

IUPAC Name: methanesulfinic acid | CAS Registry Number: 20277-69-4
Synonyms: Methanesulfinic acid, InChI=1/CH4O2S/c1-4(2)3/h1H3,(H,2,3, 17696-73-0, 76694-57-0, 81824-06-8

Molecular Formula:	CH₄O₂S	Molecular Weight:	80.106260 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: XNEFVTBPCXGIRX-UHFFFAOYSA-N

• Methyl 3-amino-5-phenylthiophene-2-carboxylate

IUPAC Name: methyl 3-amino-5-phenylthiophene-2-carboxylate | CAS Registry Number: 100063-22-7
Synonyms: Maybridge1_003977, SBB005525, ZINC00080609

Molecular Formula:	C₁₂H₁₁NO₂S	Molecular Weight:	233.286240 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: QESSCNMSOLRYBO-UHFFFAOYSA-N

• Methyl Dopa

IUPAC Name: (2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoic acid | CAS Registry Number: 555-30-6
Synonyms: methyldopa, Alphamethyldopa, Presolisin, Baypresol, Hyperpax, Sedometil, Aldomet, Medomet, Alpha medopa, Methyl dopa, Dopamethyperpax, Methoplain, Aldometil, Dopergit, Grospisk, Medopren, Presinol, Sembrina, Aldomin, Becanta

Molecular Formula:	C₁₀H₁₃NO₄	Molecular Weight:	211.214520 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	5

InChIKey: CJCSPKMFHVPWAR-JTQLQIEISA-N

• Methyl-N-(methoxycarbonyl methyl)-3-sulfamoyl Thiophene-2-carboxylate

IUPAC Name: methyl 3-[(2-methoxy-2-oxoethyl)sulfamoyl]thiophene-2-carboxylate | CAS Registry Number: 106820-63-7
Synonyms: methyl 3-[(methoxycarbonylmethyl)sulfamoyl]thiophene-2-carboxylate, Methyl N-(methoxycarbonylmethyl)-3-sulfamoyl-2-thiophenecarboxylate, 3-Sulfonyl amino methyl acetate-2-methyl carboxylatethiophene, methyl 3-(methoxycarbonylmethyl-sulfamoyl)thiophene-2-carboxylate, methyl 3-[(2-methoxy-2-oxoethyl)sulfamoyl]thiophene-2-carboxylate, methyl-n-(methoxycarbonylmethyl)-3-sulfamoylthiophene-2-carboxylate, Maybridge4_000790, methyl 3-((methoxycarbonylmethyl)sulfamoyl)thiophene-2-carboxylate, Methyl 3-(N-(2-methoxy-2-oxoethyl)sulfamoyl)thiophene-2-carboxylate, methyl 3-[n-(2-methoxy-2-oxoethyl)sulfamoyl]thiophene-2-carboxylate, AC1LET5P, ACMC-2098mf, Oprea1_433716, KSC496O6R, Jsp000605, STOCK6S-77892, CTK3J6768, MolPort-000-157-295, HMS1523D20, ANW-15445

Molecular Formula:	C₉H₁₁NO₆S₂	Molecular Weight:	293.316740 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: KUTKKTKUSGIBPZ-UHFFFAOYSA-N

• Milnacipran Hydrochloride

IUPAC Name: (1R,2S)-2-(aminomethyl)-N,N-diethyl-1-phenylcyclopropane-1-carboxamide hydrochloride | CAS Registry Number: 101152-94-7
Synonyms: Milnacipran, Dalcipran, Toledomin, Ixel, Toledomin (TN), Milnacipran hydrochloride, MLS000758229, MLS001424149, Milnacipran hydrochloride (JAN), CID163701, CPD000449266, LS-58540, LS-58541, SAM001247035, SMR000449266, F 2207, D01107, 1-Phenyl-1-(diethylaminocarbonyl)-2-(aminomethyl)cyclopropane hydrochloride, cis-(+-)-2-(Aminomethyl)-N,N-diethyl-1-phenylcyclopropanecarboxamide monohydrochloride, Cyclopropanecarboxamide, 2-(aminomethyl)-N,N-diethyl-1-phenyl-, monohydrochloride, cis-(+-)-

Molecular Formula:	C₁₅H₂₃ClN₂O	Molecular Weight:	282.808920 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: XNCDYJFPRPDERF-PBCQUBLHSA-N

• N-(4(3,4-Dichlorophenyl)-3,4-Dihydro-1(2H)Naphthalidene) methanamine

IUPAC Name: 4-(3,4-dichlorophenyl)-N-methyl-3,4-dihydro-2H-naphthalen-1-imine | CAS Registry Number: 79560-20-6
Synonyms: 4-(3,4-Dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenimine, AG-H-19143, N-(4(3,4-dichlorophenyl)-3,4-dihydro-1(2H)naphthalidene) methanamine, SureCN2778648, SureCN2778650, SureCN2779598, CTK2H7038, MolPort-003-987-244, 4-(3,4-dichlorophenyl)-N-methyl-3,4-dihydro-2H-naphthalen-1-imine, AKOS015965560, AC-20507, TL8005383, A839716, 4-(3,4-DICHLORO PHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-1-NAPHTHALENIMINE, N-(4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalene-1-one)-methanamine, N-[4-(3,4-Dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenylidene]methanamine;

Molecular Formula:	C₁₇H₁₅Cl₂N	Molecular Weight:	304.213700 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: MGBVAZJASCWJGJ-UHFFFAOYSA-N

• Naftopidil

IUPAC Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol | CAS Registry Number: 57149-07-2
Synonyms: naftopidil, Flivas, Avishot, Naftopidil [INN], Naftopidilum [Latin], Flivas (TN), Naftopidil (unspecified), Naftopidil (JAN/INN), Prestwick0_000975, Prestwick1_000975, Prestwick2_000975, Prestwick3_000975, Lopac0_000941, BSPBio_001009, MLS000759459, MLS001424117, SPBio_002920, KT-611, BPBio1_001111, NAFTOPIDIL DIHYDROCHLORIDE

Molecular Formula:	C₂₄H₂₈N₂O₃	Molecular Weight:	392.490720 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: HRRBJVNMSRJFHQ-UHFFFAOYSA-N

• Naftopidil Dihydrochloride

IUPAC Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-naphthalen-1-yloxypropan-2-ol;dihydrochloride | CAS Registry Number: 57149-08-3
Synonyms: NAFTOPIDIL DIHYDROCHLORIDE, Flivas, KT-611, BM-15275, Avishot, 57149-08-3, Flivas, KT-611, BM-15275, Avishot, Naftopidil Dihydrochloride, flivas dihydrochloride, S1387_Selleck, KT-611 dihydrochloride, EU-0100941, AGN-PC-00IQUZ, SureCN1322047, N158_SIGMA, UNII-6I80E37JBE, Naftopidil dihydrochloride [MI], MolPort-003-958-925, HMS1571C11, Naftopidil dihydrochloride, (+/-)-, AKOS015900296, CCG-220975, CCG-222245, LP00941, NCGC00094247-01

Molecular Formula:	C₂₄H₃₀Cl₂N₂O₃	Molecular Weight:	465.412600 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: HZVCEQMJXMUXJF-UHFFFAOYSA-N

• Nebivolol Hydrochloride

IUPAC Name: 1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)-2-[[2-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)-2-hydroxyethyl]amino]ethanol;hydrochloride | CAS Registry Number: 169293-50-9
Synonyms: Nebivolol hydrochloride, Nebivolol HCl, 2,2'-Azanediylbis(1-(6-fluorochroman-2-yl)ethanol) hydrochloride, 152520-56-4, rac Nebivolol hydrochloride, Nebilox, R-67555, (1S)-1-[(2R)-6-fluorochroman-2-yl]-2-[[(2S)-2-[(2R)-6-fluorochroman-2-yl]-2-hydroxyethyl]amino]ethanol hydrochloride, PubChem18274, SureCN514784, AGN-PC-00CXO2, CHEMBL1201731, CTK8C2685, MolPort-015-163-751, ABP000746, ANW-68836, Ro-67555, AKOS016006035, AC-4233, CCG-214847

Molecular Formula:	C₂₂H₂₆ClF₂NO₄	Molecular Weight:	441.895946 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	7

InChIKey: JWEXHQAEWHKGCW-UHFFFAOYSA-N

• Nilvadipine

IUPAC Name: 3-O-methyl 5-O-propan-2-yl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate | CAS Registry Number: 75530-68-6
Synonyms: nilvadipine, Nivadil, Nivadipine, Escor, Nilvadipinum [Latin], Nilvadipino [Spanish], Nivadil (TN), Nilvadipine [USAN:INN:JAN], Nilvadipine (JP15/USAN/INN), FK 235, C19H19N3O6, BRN 3572609, FK-235, FR 34235, FR-34235, SK&F 102,362, SK&F-102362, CL 287,389, NCGC00167435-01, CL-287389

Molecular Formula:	C₁₉H₁₉N₃O₆	Molecular Weight:	385.370660 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	8

InChIKey: FAIIFDPAEUKBEP-UHFFFAOYSA-N

• o-Fluoroaniline

IUPAC Name: 2-fluoroaniline | CAS Registry Number: 348-54-9
Synonyms: 2-FLUOROANILINE, Aniline, o-fluoro-, Benzenamine, 2-fluoro-, 2-Fluorobenzenamine, 1lgw, 1-Amino-2-fluorobenzene, F3401_ALDRICH, Aniline, o-fluoro- (8CI), 46470_FLUKA, NSC10299, EINECS 206-478-9, NSC 10299, UN2941, ZINC00157599, TL806458, AI3-52644, ST5213785, C11010, o-Fluoroaniline [UN2941] [Keep away from food], InChI=1/C6H6FN/c7-5-3-1-2-4-6(5)8/h1-4H,8H

Molecular Formula:	C₆H₆FN	Molecular Weight:	111.116943 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: FTZQXOJYPFINKJ-UHFFFAOYSA-N

• O-Fluoronitrobenzene

IUPAC Name: 1-fluoro-2-nitrobenzene | CAS Registry Number: 1493-27-2
Synonyms: o-Fluoronitrobenzene, 1-Fluoro-2-nitrobenzene, o-Nitrofluorobenzene, 2-Nitrofluorobenzene, 2-Fluoronitrobenzene, Benzene, o-nitrofluoro-, Benzene, 1-fluoro-2-nitro-, F10801_ALDRICH, CID73895, NSC51869, EINECS 216-088-0, NSC 51869, ZINC01682934, TL8001073, InChI=1/C6H4FNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4

Molecular Formula:	C₆H₄FNO₂	Molecular Weight:	141.099863 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: PWKNBLFSJAVFAB-UHFFFAOYSA-N

• Octocrylene

IUPAC Name: 2-ethylhexyl 2-cyano-3,3-di(phenyl)prop-2-enoate | CAS Registry Number: 6197-30-4
Synonyms: Octocrilene, Capital Soleil, Mixture Name, Anthelios SX, UV Absorber-3, Octocrylene [USAN], Octocrilene (INN), Octocrylene (USP), Octocrilenum [INN-Latin], Octocrileno [INN-Spanish], CCRIS 4814, 2-Ethylhexyl 2-cyano-3,3-diphenylacrylate, 415820_ALDRICH, EINECS 228-250-8, LS-1477, 2-Ethylhexyl 2-cyano-3,3-diphenyl-2-propenoate, NCGC00091585-01, NCGC00091585-03, 2-ETHYLHEXYL-2-CYANO-3,3-DIPHENYLACRYLATE, 2-Ethylhexyl 2-cyano-3,3-diphenyl-2-acrylate

Molecular Formula:	C₂₄H₂₇NO₂	Molecular Weight:	361.476680 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: FMJSMJQBSVNSBF-UHFFFAOYSA-N

• Oxatomide

IUPAC Name: 3-[3-[4-[di(phenyl)methyl]piperazin-1-yl]propyl]-1H-benzimidazol-2-one | CAS Registry Number: 60607-34-3
Synonyms: oxatomide, Tinset, Oxatimide, Oxatomida, Celtect, Oxetal, Oxatomide (tinset), Celtect (TN), Oxatomidum [INN-Latin], Oxatomida [INN-Spanish], Lopac-O-9387, CBMicro_024634, Lopac0_000924, McN-JR 35443, Oprea1_338592, MLS000028549, Oxatomide (JAN/USAN/INN), O9387_SIGMA, Oxatomide [USAN:BAN:INN:JAN], C27H30N4O

Molecular Formula:	C₂₇H₃₀N₄O	Molecular Weight:	426.553300 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: BAINIUMDFURPJM-UHFFFAOYSA-N

• Pinacol

IUPAC Name: 2,3-dimethylbutane-2,3-diol | CAS Registry Number: 76-09-5
Synonyms: PINACOL, Pinacone, Tetramethylethylene glycol, 2,3-Dimethyl-2,3-butanediol, 2,3-Butanediol, 2,3-dimethyl-, 2,3-Dimethylbutane-2,3-diol, 221171_ALDRICH, 80580_FLUKA, EINECS 200-933-5, 1,1,2,2-Tetramethylethylene glycol, NSC 25943, WLN: QX1&1&XQ1&1, AIDS017553, BM567, AIDS-017553, NSC25943, BRN 1340501, meso-2,3-Dimethyl-2,3-butanediol, ZINC00391890, AI3-02251

Molecular Formula:	C₆H₁₄O₂	Molecular Weight:	118.174160 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: IVDFJHOHABJVEH-UHFFFAOYSA-N

• Potassium Thioacetate

IUPAC Name: ethanethioic S-acid | CAS Registry Number: 10387-40-3
Synonyms: Thiacetic acid, Acetyl mercaptan, Ethanethioic acid, Thiolacetic acid, THIOACETIC ACID, Thioacetic S-acid, Thioacetate, Thionoacetic acid, Schiff's reagent, Ethanethioic S-acid, Ethanethiolic acid, Methanecarbothiolic acid, Acetic acid, thio-, ethanethioic O-acid, CH3COSH, Kyselina thiooctova [Czech], USAF EK-P-737, T30805_ALDRICH, Acetyl-[acyl-carrier protein], 88620_FLUKA

Molecular Formula:	C₂H₄OS	Molecular Weight:	76.117560 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: DUYAAUVXQSMXQP-UHFFFAOYSA-N

• Pyrantel Pamoate

IUPAC Name: 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid; 1-methyl-2-[(E)-2-thiophen-2-ylethenyl]-5,6-dihydro-4H-pyrimidine | CAS Registry Number: 22204-24-6
Synonyms: pyrantel pamoate, Antiminth, Combantrin, Embovin, Drontal, Pyrantel embonate, Drontal Plus, Mixture Name, Heartgard-30 Plus, Pamoate, Pyrantel, Antiminth (TN), Embonate, Pyrantel, Spectrum5_001373, Pyrantel pamoate [USAN:JAN], SPECTRUM1500517, Pyrantel pamoate (JP15/USP), EINECS 244-837-1, AIDS092504, NSC 355080, AIDS-092504

Molecular Formula:	C₃₄H₃₀N₂O₆S	Molecular Weight:	594.676800 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	8

InChIKey: AQXXZDYPVDOQEE-MXDQRGINSA-N

• Quetiapine Fumarate

IUPAC Name: 2-[2-(4-benzo[b][1,5]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethanol; 2-[2-(4-benzo[b][1,5]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethanol; (E)-but-2-enedioic acid | CAS Registry Number: 111974-72-2
Synonyms: Seroquel, quetiapine, Quetiapine fumarate, Seroquel XR, Seroquel (TN), Ambap1222, Quetiapine fumarate [USAN], Quetiapine fumarate (JAN/USAN), ZD5077, 2C21H25N3O2S.C4H4O4, ICI-204636, ICI 204,636, LS-66641, ZM 204636, ZM 204,636, D00458, 2-(2-(4-Dibenzo(b,f)(1,4)thiazepine-11-yl-1-piperazinyl)ethoxy)ethanol, 2-(2-(4-Dibenzo(b,f)(1,4)thiazepin-11-yl-1-piperazinyl)ethoxy)ethanol fumarate (2:1) (salt), 2-[2-(4-dibenzo [b,f ] [1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]-ethanol fumarate (2:1) (salt), Ethanol, 2-(2-(4-dibenzo(b,f)(1,4)thiazepin-11-yl-1-piperazinyl)ethoxy)-, (E)-2-butenedioate (2:1) (salt)

Molecular Formula:	C₄₆H₅₄N₆O₈S₂	Molecular Weight:	883.086360 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	14

InChIKey: ZTHJULTYCAQOIJ-WXXKFALUSA-N

• Sucralose

IUPAC Name: (2R,3R,4R,5R,6R)-2-[(2R,3S,4S,5S)-2,5-bis(chloromethyl)-3,4-dihydroxyoxolan-2-yl]oxy-5-chloro-6-(hydroxymethyl)oxane-3,4-diol | CAS Registry Number: 56038-13-2
Synonyms: Trichlorosucrose, Sucralose [BAN], EINECS 259-952-2, 1',4,6'-Trichlorogalactosucrose, CID71485, BRN 3654410, LS-71002, TL8003643, C12285, 4,1',6'-Trichloro-4,1',6'-trideoxy-galacto-sucrose, 1,6-Dichloro-1,6-dideoxy-beta-D-fructofuranosyl 4-chloro-4-deoxy-alpha-D-galactopyranoside, 1,6-Dichloro-1,6-dideoxy-beta-D-fructofuranosyl 4-chloro-4-deoxy-alpha-D-galactose, alpha-D-Galactopyranoside, 1,6-dichloro-1,6-dideoxy-beta-D-fructofuranosyl 4-chloro-4-deoxy-, 1,6-Dichloro-1,6-dideoxy-beta-D-fructofuranosyl-4-chloro-4-deoxy-alpha-D-galactopyranoside

Molecular Formula:	C₁₂H₁₉Cl₃O₈	Molecular Weight:	397.633460 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	8

InChIKey: BAQAVOSOZGMPRM-QBMZZYIRSA-N

• Thioacetic Acid

IUPAC Name: ethanethioic S-acid | CAS Registry Number: 507-09-5
Synonyms: Thiacetic acid, Acetyl mercaptan, Ethanethioic acid, Thiolacetic acid, THIOACETIC ACID, Thioacetic S-acid, Thioacetate, Thionoacetic acid, Schiff's reagent, Ethanethioic S-acid, Ethanethiolic acid, Methanecarbothiolic acid, Acetic acid, thio-, ethanethioic O-acid, CH3COSH, Kyselina thiooctova [Czech], USAF EK-P-737, T30805_ALDRICH, Acetyl-[acyl-carrier protein], 88620_FLUKA

Molecular Formula:	C₂H₄OS	Molecular Weight:	76.117560 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: DUYAAUVXQSMXQP-UHFFFAOYSA-N

• Thiofuran

IUPAC Name: thiophene | CAS Registry Number: 110-02-1
Synonyms: THIOPHENE, Thiophen, Thiole, Thiacyclopentadiene, Thiofurfuran, Thiotetrole, Thiaphene, Thiofuram, Divinylene sulfide, Furan, thio-, Huile HSO, Polythiophene, Thiofen [Czech], Huile H50, Thiophene, homopolymer, USAF EK-1860, WLN: T5SJ, CCRIS 2935, HSDB 130, CP 34

Molecular Formula:	C₄H₄S	Molecular Weight:	84.139560 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: YTPLMLYBLZKORZ-UHFFFAOYSA-N

• Torsemide

IUPAC Name: 1-[4-(3-methylanilino)pyridin-3-yl]sulfonyl-3-propan-2-ylurea | CAS Registry Number: 56211-40-6
Synonyms: Torasemide, Demadex, TORSEMIDE, Luprac, Presoril, Toradiur, Torocard, Dilutol, Sutril, Torrem, Torem, Unat, Torasemide N, Torsemide [USAN], Torsemide (USP), Demadex (TN), Luprac (TN), Torasemidum [INN-Latin], Torasemida [INN-Spanish], Ambap3994

Molecular Formula:	C₁₆H₂₀N₄O₃S	Molecular Weight:	348.420000 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: NGBFQHCMQULJNZ-UHFFFAOYSA-N

• Tropini sulfas

IUPAC Name: [(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate; sulfuric acid; hydrate | CAS Registry Number: 5908-99-6
Synonyms: Isopto Atropine, Atropine sulfate, Prestwick_960, Isopto Atropine (TN), Atropine sulfate monohydrate, Atropine sulfate (JP15/USP), D02069

Molecular Formula:	C₃₄H₅₀N₂O₁₁S	Molecular Weight:	694.832600 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	13

InChIKey: JPKKQJKQTPNWTR-BRYCGAMXSA-N

• Trospium Chloride

IUPAC Name: [(1R,5S)-spiro[8-azoniabicyclo[3.2.1]octane-8,1'-azolidin-1-ium]-3-yl] 2-hydroxy-2,2-diphenylacetate chloride | CAS Registry Number: 10405-02-4
Synonyms: trospium chloride, 3-((hydroxydiphenylacetyl)oxy)-spiro(8-azoniabicyclo(3.2.1)octane-8,1'-pyrrolidinium chloride

Molecular Formula:	C₂₅H₃₀ClNO₃	Molecular Weight:	427.963600 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: RVCSYOQWLPPAOA-DHWZJIOFSA-M

• Vitamin D 3

IUPAC Name: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol | CAS Registry Number: 67-97-0
Synonyms: cholecalciferol, Vitamin D3, Calciol, Colecalciferol, Ricketon, Trivitan, Vigorsan, Deparal, Colecalcipherol, Arachitol, Delsterol, Vigantol, Quintox, Rampage, Ebivit, Oleovitamin D3, Cholecalciferolum, D3-Vicotrat, D3-Vigantol, FeraCol

Molecular Formula:	C₂₇H₄₄O	Molecular Weight:	384.637660 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: QYSXJUFSXHHAJI-YRZJJWOYSA-N

• Vitamin D3

IUPAC Name: (1S,3Z)-3-[(2E)-2-[(1R,7aR)-1-(5,6-dimethylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol | CAS Registry Number: 511-28-4
Synonyms: Vitamin D4, EINECS 208-127-5, CID6450185, 9,10-Secoergosta-5(Z),7(E),10(19)-trien-3beta-ol, 9,10-Secocholesta-5,7,10(9)-trien-3-ol, 24-methyl-

Molecular Formula:	C₂₈H₄₆O	Molecular Weight:	398.664240 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: DIPPFEXMRDPFBK-MNURULJVSA-N

• 4-Phenyl 1-butyl bromide

IUPAC Name: 4-bromobutylbenzene | CAS Registry Number: 13633-25-5
Synonyms: (4-Bromobutyl)benzene, 4-Phenylbutyl bromide, 1-Bromo-4-phenylbutane, 4-Phenyl-1-bromobutane, Benzene, (4-bromobutyl)-, 1-Bromo-4-phenyl-butane, NCIOpen2_006323, NSC89816

Molecular Formula:	C₁₀H₁₃Br	Molecular Weight:	213.114220 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: XPBQQAHIVODAIC-UHFFFAOYSA-N

• 1,4,7,10-Tetracyclododecane

IUPAC Name: 3,6,9,12-tetrazacyclododecane | CAS Registry Number: 294-90-6
Synonyms: Cyclen, 1,4,7,10-Tetraazacyclododecane, Cyclen IPS1, [12]aneN4, MLS000069489, 339652_ALDRICH, TPC-M003, CHEBI:37391, AIDS051704, NSC629374(FREE BASE), NSC 629374, AIDS-051704, BRN 0606114, NSC629374, 294-90-6(FREE BASE), NCGC00018128-01, NCI60_009514, SMR000059056, LS-148829, ST5306895

Molecular Formula:	C₈H₂₀N₄	Molecular Weight:	172.271200 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	4

InChIKey: QBPPRVHXOZRESW-UHFFFAOYSA-N

• 2-Cyanophenothiazine

IUPAC Name: 10H-phenothiazine-2-carbonitrile | CAS Registry Number: 38642-74-9
Synonyms: Phenothiazine-2-carbonitrile, NSC170554, CID98841, EINECS 254-057-3, ZINC01688610

Molecular Formula:	C₁₃H₈N₂S	Molecular Weight:	224.281020 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: XZSIGWOVDPSPMG-UHFFFAOYSA-N

• 2,4-Difluoronitrobenzene

IUPAC Name: 2,4-difluoro-1-nitrobenzene | CAS Registry Number: 446-35-5
Synonyms: 2,4-Difluoro-1-nitrobenzene, 1,3-Difluoro-4-nitrobenzene, 1-Nitro-2,4-difluorobenzene, Benzene, 2,4-difluoro-1-nitro-, MLS001055483, 233226_ALDRICH, EINECS 207-167-0, NSC 10259, NSC10259, BRN 2048034, ZINC00164453, NCGC00090989-01, LS-29844, SMR001227187, 4-05-00-00720 (Beilstein Handbook Reference)

Molecular Formula:	C₆H₃F₂NO₂	Molecular Weight:	159.090326 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: RJXOVESYJFXCGI-UHFFFAOYSA-N

• 3-Chloropropiophenone

IUPAC Name: 3-chloro-1-phenylpropan-1-one | CAS Registry Number: 936-59-4
Synonyms: beta-Chloropropiophenone, .beta.-Chloropropiophenone, 3-Chloropropanophenone, Propiophenone, 3-chloro-, omega-Chloropropiophenone, 2-Chloroethyl phenyl ketone, 1-Propanone, 3-chloro-1-phenyl-, .omega.-Chloropropiophenone, beta-Chloroethyl phenyl ketone, 335614_ALDRICH, 3-Chloro-1-phenyl-1-propanone, .beta.-Chloroethyl phenyl ketone, 26226_FLUKA, NSC37238, EINECS 213-317-6, NSC 37238, NSC227202, ZINC01669834, NSC 227202

Molecular Formula:	C₉H₉ClO	Molecular Weight:	168.620160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: KTJRGPZVSKWRTJ-UHFFFAOYSA-N

• 1-(2-methoxyphenyl)piperazinehydrochloride

IUPAC Name: 1-(2-methoxyphenyl)piperazine chloride | CAS Registry Number: 5464-78-8
Synonyms: NSC28709, EINECS 226-762-6, 1-(2-Methoxyphenyl)piperazinium chloride

Molecular Formula:	C₁₁H₁₆ClN₂O-	Molecular Weight:	227.710540 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: DDMVHGULHRJOEC-UHFFFAOYSA-M

• 3-Acetylthianaphthene

IUPAC Name: 1-(1-benzothiophen-3-yl)ethanone | CAS Registry Number: 26168-40-1
Synonyms: 3-Acetylthionaphthene, 3-Acetylbenzothiophene, 1128-05-8, 3-Acetylbenzo[b]thiophene, KETONE, METHYL 3-THIANAPHTHENYL, Ethanone, 1-benzo(b)thien-3-yl-, 3-Acetylbenzo(b)thiophene, 1-(1-Benzothien-3-yl)ethanone, 1-(1-benzothiophen-3-yl)ethanone, 1-(benzo[b]thiophen-3-yl)ethanone, NSC 3226, SBB066387, BRN 0122587, 1-(1-Benzothiophen-3-Yl)Ethan-1-One, AI3-18374, Ethanone, 1-benzo[b]thien-3-yl-, Ketone, benzo(b)thien-3-yl methyl, Ketone, benzo[b]thien-3-yl methyl, 3-Acetyl benzothiophene, ACMC-1BVUS

Molecular Formula:	C₁₀H₈OS	Molecular Weight:	176.234920 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: ZTTZKDDWXHQKSY-UHFFFAOYSA-N

• 1,2-Dihydroxyquinazoline

IUPAC Name: 1H-quinazoline-2,4-dione | CAS Registry Number: 86-96-4
Synonyms: Benzoyleneurea, Benzouracil, Quinazolinedione, Urea, benzoylene-, Quinazoline-2,4-dione, 2,4-Dihydroxyquinazoline, 2,4(1H,3H)-Quinazolinedione, 2-Keto-4-quinazolinone, Quinazoline-2,4-diol, Maybridge1_000647, WLN: T66 BMVMVJ, 2,4-Dioxotetrahydroquinazoline, Oprea1_764687, 1H-quinazoline-2,4-quinone, MLS000762991, 142026_ALDRICH, (1H,3H)-Quinazoline-2,4-dione, 2.4(1H,3H)-Quinazolinedione, NSC 2108, STOCK5S-55032

Molecular Formula:	C₈H₆N₂O₂	Molecular Weight:	162.145440 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: SDQJTWBNWQABLE-UHFFFAOYSA-N

• 4,4'-phenyl isocyanate

IUPAC Name: 1,4-diisocyanatobenzene | CAS Registry Number: 104-49-4
Synonyms: 1,4-Diisocyanatobenzene, p-Phenylene diisocyanate, p-Phenylene isocyanate, 1,4-Phenylene diisocyanate, Isocyanic acid, p-phenylene ester, BENZENE, 1,4-DIISOCYANATO-, NCIOpen2_001342, 262242_ALDRICH, EINECS 203-207-6, NSC 94776, CID61009, NSC94776, LS-377, 1,4-Phenylene diisocyanate [Diisocyanates], Isocyanic acid, p-phenylene ester (6CI,7CI,8CI), 51807-23-9

Molecular Formula:	C₈H₄N₂O₂	Molecular Weight:	160.129560 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: ALQLPWJFHRMHIU-UHFFFAOYSA-N