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Shanghai APIs Chemical Co., Ltd.

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Profile: Shanghai APIs Chemical Co., Ltd. is specializes in manufacturer of API chemicals to various chemical induistries.

51 to 100 of 713 Products/Chemicals (Click for related suppliers)  Page: << Previous 50 Results 1 [2] 3 4 5 6 7 8 9 10 11 12 13 14 15 >> Next 50 Results
• Azetidine, 3-fluoro-, hydrochloride
IUPAC Name: 3-fluoroazetidine;hydrochloride | CAS Registry Number: 617718-46-4
Synonyms: 3-fluoroazetidine Hydrochloride, 3-Fluoroazetidine HCl, 3-FluoroazetidineHydrochloride, 3-Fluoroazetane hydrochloride, AG-G-25412, ACMC-20dlgf, 3-fluoroazethidine HCl, SureCN219848, KSC941O8N, CTK8E1786, MolPort-004-968-993, 3-FLUOROAZETIDINE HCL SALT, HT038, ACN-S001931, PC8943, RW3476, SC2901, AKOS005063310, EF10145, QC-2343

Molecular Formula: C3H7ClFNMolecular Weight: 111.545783 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PXFUWRWCKSLCLS-UHFFFAOYSA-N

• Azetidine-2-carboxylic acid
IUPAC Name: azetidine-2-carboxylic acid | CAS Registry Number: 20063-89-2
Synonyms: Azetidinecarboxylic acid, L-Azetidine-2-carboxylic acid, 2-AZETIDINECARBOXYLIC ACID, DL-2-Azetidinecarboxylic acid, CHEBI:38108, (+-)-2-Azetidinecarboxylic acid, CID17288, NSC72471, EINECS 219-740-2, (S)-(-)-2-Azetidinecarboxlic acid, AZETIDINE-2-CARBOXYLICACID (L-), TL8001772, 2517-04-6

Molecular Formula: C4H7NO2Molecular Weight: 101.103880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IADUEWIQBXOCDZ-UHFFFAOYSA-N

• Azetidine-3-ylmethyl-carbamic Acid Tert-butyl Ester
IUPAC Name: tert-butyl N-(azetidin-3-ylmethyl)carbamate | CAS Registry Number: 91188-15-7
Synonyms: 3-Boc-aminomethylazetidine, 3-(n-boc-aminomethyl)azetidine, 3-(boc-aminomethyl)azetidine, tert-butyl N-(azetidin-3-ylmethyl)carbamate, 3-boc-aminomethyl-azetidine, tert-butyl azetidin-3-ylmethylcarbamate, 3-(n-boc)aminomethylazetidine, tert-butylazetidin-3-ylmethylcarbamate, AG-H-74115, tert-butyl [(azetidin-3-yl)methyl]carbamate, azetidine-3-ylmethyl-carbamic acid tert-butyl ester, CARBAMIC ACID, N-(3-AZETIDINYLMETHYL)-, 1,1-DIMETHYLETHYL ESTER, 3-{[(tert-Butoxycarbonyl)amino]methyl}azetidine, 3-[[(TERT-BUTOXYCARBONYL)AMINO]METHYL]AZETIDINE, PubChem10158, AC1Q1NEP, AGN-PC-00OYUH, SureCN1034818, CTK3I6612, azetidin-3-yl(neopentyl)carbamate

Molecular Formula: C9H18N2O2Molecular Weight: 186.251420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: MOLUHRBHXXGWDP-UHFFFAOYSA-N

• Aztreonam
IUPAC Name: 2-[[1-(2-amino-1,3-thiazol-4-yl)-2-[[(2S,3S)-2-methyl-4-oxo-1-sulfoazetidin-3-yl]amino]-2-oxoethylidene]amino]oxy-2-methylpropanoic acid | CAS Registry Number: 78110-38-0
Synonyms: aztreonam, Azactam, Primbactam, Prestwick_914, Prestwick2_000185, Prestwick3_000185, BSPBio_000109, NSC646279, BPBio1_000121, AIDS013397, AIDS-013397, CID5742832, NCGC00179656-01, SQ-26776, [2S-[2alpha,3beta(Z)]]-2-[[[1-(2-Amino-4-thiazolyl)-2-[(2-methyl-4-oxo-1-sulfo-3-azetidinyl)amino]-2-oxoethylidene]amino]oxy]-2-methylpropanoic acid, 2-({[(1Z)-1-(2-amino-1,3-thiazol-4-yl)-2-{[(2S,3S)-2-methyl-4-oxo-1-sulfoazetidin-3-yl]amino}-2-oxoethylidene]amino}oxy)-2-methylpropanoic acid

Molecular Formula: C13H17N5O8S2Molecular Weight: 435.432780 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: WZPBZJONDBGPKJ-VEHQQRBSSA-N

• Barasertib
IUPAC Name: 2-[ethyl-[3-[4-[[5-[2-(3-fluoroanilino)-2-oxoethyl]-1H-pyrazol-3-yl]amino]quinazolin-7-yl]oxypropyl]amino]ethyl dihydrogen phosphate | CAS Registry Number: 722543-31-9
Synonyms: AZD1152, AZD-1152, 957881-03-7, 2-(ETHYL(3-((4-((5-(2-((3-FLUOROPHENYL)AMINO)-2-OXOETHYL)-1H-PYRAZOL-3-YL)AMINO)QUINAZOLIN-7-YL)OXY)PROPYL)AMINO)ETHYL DIHYDROGEN PHOSPHATE, Barasertib [INN], Kinome_3324, PubChem16656, AZD1152 (Barasertib), SureCN613582, UNII-16XC2U7W8N, cc-444, CHEMBL415049, CHEBI:463089, BCPP000362, ABP000116, BCP9000360, CS-0978, AK142987, HY-10127, KB-65305

Molecular Formula: C26H31FN7O6PMolecular Weight: 587.539805 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 12

InChIKey: GBJVVSCPOBPEIT-UHFFFAOYSA-N

• Barasertib-HQPA
IUPAC Name: 2-[3-[[7-[3-[ethyl(2-hydroxyethyl)amino]propoxy]quinazolin-4-yl]amino]-1H-pyrazol-5-yl]-N-(3-fluorophenyl)acetamide | CAS Registry Number: 722544-51-6
Synonyms: AZD1152-HQPA, AZD-1152HQPA, AZD 1152, Barasertib, AZD1152, 722544-51-6, 2-[5-(7-{3-[Ethyl-(2-hydroxy-ethyl)-amino]-propoxy}-quinazolin-4-ylamino)-2H-pyrazol-3-yl]-N-(3-fluoro-phenyl)-acetamide, 5-[[7-[3-[Ethyl(2-hydroxyethyl)amino]propoxy]-4-quinazolinyl]amino]-N-(3-fluorophenyl)-1H-pyrazole-3-acetamide, Barasertib, AZD1152-HQPA, INH 34, S1147_Selleck, Kinome_3323, PubChem16768, cc-48, SureCN1343965, UNII-29P8LWS24N, AZD1152-HQPA,Barasertib, SureCN10102580, AZD-1152-HQPA, AZD 1152 HQPA Barasertib, AZD-1152-HQPA;Barasertib, CHEMBL215152

Molecular Formula: C26H30FN7O3Molecular Weight: 507.559903 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 9

InChIKey: QYZOGCMHVIGURT-UHFFFAOYSA-N

• Benzenamine, 3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)-
IUPAC Name: 3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)aniline | CAS Registry Number: 641571-11-1
Synonyms: 3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)aniline, SBB070660, 1-(3-Amino-5-trifluoromethylphenyl)-4-methylimidazole, AG-G-40451, 3-(4-METHYL-1H-IMIDAZOL-1-YL)-5-(TRIFLUOROMETHYL)BENZENAMINE, AGN-PC-00JLUU, SureCN589390, 3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)aniline, BEN745, CTK2F2674, MolPort-008-155-922, ANW-54160, AKOS015842181, MB10071, RP28481, AK-38398, BR-38398, KB-27154, AB1004626, A8805

Molecular Formula: C11H10F3N3Molecular Weight: 241.212410 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: WWTGXYAJVXKEKL-UHFFFAOYSA-N

• Benzene, 4-[(2R)-2-(bromomethyl)-3-methylbutyl]-1-methoxy-2-(3-methoxypropoxy)-
IUPAC Name: 4-[(2R)-2-(bromomethyl)-3-methylbutyl]-1-methoxy-2-(3-methoxypropoxy)benzene | CAS Registry Number: 172900-69-5
Synonyms: 2-(3-Methoxypropoxy)-4-((R)-2-(bromomethyl)-3-methylbutyl)-1-methoxybenzene, AG-E-22303, (R)-4-(2-(BROMOMETHYL)-3-METHYLBUTYL)-1-METHOXY-2-(3-METHOXYPROPOXY)BENZENE, (R)-4-[2-(Bromomethyl)-3-methylbutyl]-1-methoxy-2-(3-methoxypropoxy)benzene, SureCN4300111, CTK4D4409, ANW-48329, SBB070983, ZINC38548618, AKOS015851736, AKOS015888737, AK-33680, BR-33680, AM20090747, X0116, (2R)-2-[4-methoxy-3-(3-methoxypropoxy)benzyl]-3-methylbutyl bromide, Benzene,4-[(2R)-2-(bromomethyl)-3-methylbutyl]-1-methoxy-2-(3-methoxypropoxy)-, Benzene,4-[2-(bromomethyl)-3-methylbutyl]-1-methoxy-2-(3-methoxypropoxy)-, (R)-;

Molecular Formula: C17H27BrO3Molecular Weight: 359.298480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ICJBMWOVLFPLFP-HNNXBMFYSA-N

• Benzene, 4-[(2R)-2-(chloromethyl)-3-methylbutyl]-1-methoxy-2-(3-methoxypropoxy)-
IUPAC Name: 4-[(2R)-2-(chloromethyl)-3-methylbutyl]-1-methoxy-2-(3-methoxypropoxy)benzene | CAS Registry Number: 324763-39-5
Synonyms: (R)-4-(2-(chloromethyl)-3-methylbutyl)-1-methoxy-2-(3-methoxypropoxy)benzene, 4-[(2R)-2-(Chloromethyl)-3-methylbutyl]-1-methoxy-2-(3-methoxypropoxy)benzene, AG-F-08585, PubChem20512, SureCN188718, CTK1C2240, 4-[(2R)-2-(CHLOROMETHYL)-3-METHYLBUTYL]-1-METHOXY-2-(3-METHOXYPROPOXY)-BENZENE, ANW-46428, SBB070964, ZINC38548617, AKOS015852573, AKOS015890623, PB13385, AK-86198, KB-188454, AM20090743, FT-0654047, X0245, I01-7215, 2-(3-methoxypropoxy)-4-[(R)-2-(chloromethyl)-3-methylbutyl]-1-methoxybenzene;Benzene,4-[(2R)-2-(chloromethyl)-3-methylbutyl]-1-methoxy-2-(3-methoxypropoxy)-;

Molecular Formula: C17H27ClO3Molecular Weight: 314.847480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OYYMMVGLRJVHEE-HNNXBMFYSA-N

• Benzene, 4-bromo-1-chloro-2-[(4-ethoxyphenyl)methyl]-
IUPAC Name: 4-bromo-1-chloro-2-[(4-ethoxyphenyl)methyl]benzene | CAS Registry Number: 461432-23-5
Synonyms: 4-bromo-1-chloro-2-(4-ethoxybenzyl)benzene, SBB054221, 4-(5-Bromo-2-chlorobenzyl)phenyl ethyl ether, PubChem19265, SureCN38150, AGN-PC-0CTD6H, BEN221, CTK1D5537, MolPort-008-266-773, ACN-S002204, AMX10146, ANW-66595, ZINC34781172, AKOS015917373, AG-B-99330, AK-37459, KB-41979, 5-Bromo-2-chloro-4'-ethoxydiphenylmethane, 2-(4-ethoxybenzyl)-4-bromo-1-chlorobenzene, AM20040524

Molecular Formula: C15H14BrClOMolecular Weight: 325.628060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZUNCHZBITMUSRD-UHFFFAOYSA-N

• Benzene, 5-bromo-1,2-diethoxy-3-fluoro-
IUPAC Name: 1-bromo-2-methoxy-3-nitrobenzene | CAS Registry Number: 876861-32-4
Synonyms: 1-bromo-2-methoxy-3-nitrobenzene, 98775-19-0, 1-BROMO-2-METHOXY-3-NITRO-BENZENE, 2-Bromo-6-nitroanisole, AN-584/43409814, PubChem16795, ACMC-1AIDP, 2-bromo-6-nitro-anisole, SureCN1707141, KSC496G1R, 3-Bromo-2-methoxynitrobenzene, BEN750, CTK3J6318, MolPort-005-943-612, 3-bromo-2-methoxy-1-nitrobenzene, ANW-40959, SBB097845, ZINC19872893, 1-bromanyl-2-methoxy-3-nitro-benzene, AKOS015851656

Molecular Formula: C7H6BrNO3Molecular Weight: 232.031440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YAYBLVOBUIXMQY-UHFFFAOYSA-N

• Benzil Dimethyl Ketal
IUPAC Name: 2,2-dimethoxy-1,2-di(phenyl)ethanone | CAS Registry Number: 24650-42-8
Synonyms: Kayacure BDMK, Lucirin BDK, Photomer 51, Esacure KB 1, Irgacure 621, Irgacure 641, Irgacure 651, Irgacure 951, DMPA, Benzil dimethyl ketal, Irgacure E 651, Irgacure I 651, Benzil dimethyl acetal, Benzil mono(dimethyl ketal), Benzil mono(dimethyl acetal), ChemDiv3_000525, 2,2-Dimethoxy-2-phenylacetophenone, KB 1, 2,2-Dimethoxyphenylacetophenone, Oprea1_031777

Molecular Formula: C16H16O3Molecular Weight: 256.296440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: KWVGIHKZDCUPEU-UHFFFAOYSA-N

• Benzoic Acid, 4-Methyl-3-[[4-(3-Pyridinyl)-2-Pyrimidinyl]amino]-
IUPAC Name: 4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzoic acid | CAS Registry Number: 641569-94-0
Synonyms: 4-Methyl-3-((4-(pyridin-3-yl)pyrimidin-2-yl)amino)benzoic acid, SBB063316, 4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-benzoicacid, 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid, 4-methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzoic acid, Benzoic acid, 4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-, 4-methyl-3-((4-(3-pyridinyl)-2-pyrimidinyl)amino)benzoic acid, SureCN533540, BEN740, CTK8C3847, MolPort-008-155-923, ANW-70664, AKOS015888621, AK-93453, KB-86531, AB1004625, A8804, AM20090654, FT-0655847, I01-1255

Molecular Formula: C17H14N4O2Molecular Weight: 306.318660 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: LDLZPHLSVKGFSC-UHFFFAOYSA-N

• Benzophenones
IUPAC Name: di(phenyl)methanone | CAS Registry Number: 119-61-9
Synonyms: BENZOPHENONE, Diphenyl ketone, diphenylmethanone, Benzoylbenzene, Phenyl ketone, Methanone, diphenyl-, alpha-Oxoditane, Ketone, diphenyl, Diphenylketone, Benzene, benzoyl-, 1dzp, alpha-Oxodiphenylmethane, .alpha.-Oxoditane, di(phenyl)methanone, Caswell No. 081G, WLN: RVR, .alpha.-Oxodiphenylmethane, CCRIS 629, UPCMLD-DP071, BENZOPHENONE (8CI)

Molecular Formula: C13H10OMolecular Weight: 182.217900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RWCCWEUUXYIKHB-UHFFFAOYSA-N

• BI-78D3
IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1H-1,2,4-triazol-5-one | CAS Registry Number: 883065-90-5
Synonyms: CHEBI:622064, MolPort-002-926-896, ZINC12370057, CID2747117, CID 2747117, EN002866, SR-01000645315-1, 4-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5-(5-nitrothiazol-2-ylthio)-4H-1,2,4-triazol-3-ol

Molecular Formula: C13H9N5O5S2Molecular Weight: 379.371060 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: QFRLDZGQEZCCJZ-UHFFFAOYSA-N

• BIBF 1120
IUPAC Name: methyl (3Z)-3-[[4-[methyl-[2-(4-methylpiperazin-1-yl)acetyl]amino]anilino]-phenylmethylidene]-2-oxo-1H-indole-6-carboxylate | CAS Registry Number: 928326-83-4
Synonyms: Vargatef, BIBF-1120, BIBF1120, Nintedanib, Vargatef, BIBF1120, (Z)-methyl 3-((4-(N-methyl-2-(4-methylpiperazin-1-yl)acetamido)phenylamino)(phenyl)methylene)-2-oxoindoline-6-carboxylate, 656247-17-5, S1010_Selleck, BIBF1120,Vargatef, PubChem20543, Bibf1120 - Vargatef, Nintedanib (USAN/INN), Vargatef, BIBF 1120, cc-88, SureCN431006, CHEMBL502835, QCR-43, CHEBI:622730, RS0107, AKOS005145820

Molecular Formula: C31H33N5O4Molecular Weight: 539.624820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: XZXHXSATPCNXJR-ZIADKAODSA-N

• BIBF-1120
IUPAC Name: 5-[[4-(3-chloro-4-fluoroanilino)-6-oxo-7H-pyrrolo[2,3-d]pyrimidin-5-ylidene]methyl]-4-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-2-carboxamide;hydrochloride | CAS Registry Number: 346599-65-3
Synonyms: 5-[[4-[(3-Chloro-4-fluorophenyl)amino]-6,7-dihydro-6-oxo-5H-pyrrolo[2,3-d]pyrimidin-5-ylidene]methyl]-4-methyl-N-[2-(4-morpholinyl)ethyl]-1H-pyrrole-2-carboxamide hydrochloride

Molecular Formula: C25H26Cl2FN7O3Molecular Weight: 562.423443 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 8

InChIKey: CLVDFRRQUCVMJY-UHFFFAOYSA-N

• BIBR 1532
IUPAC Name: 2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid | CAS Registry Number: 321674-73-1
Synonyms: BIBR1532, BIBR-1532, BIBR1532, BIBR-1532, (E)-2-(3-(naphthalen-2-yl)but-2-enamido)benzoic acid, S1186_Selleck, CHEMBL27323, CHEBI:135302, ABP000274, CS-0902, BIBR1532-Supplied by Selleck Chemicals, NCGC00242492-01, HY-17353, KB-47975, X7524, BIBR 1532|321674-73-1|BIBR-1532, 2-[(2E)-3-(naphthalen-2-yl)but-2-enamido]benzoic acid

Molecular Formula: C21H17NO3Molecular Weight: 331.364580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: PGFQXGLPJUCTOI-WYMLVPIESA-N

• Binap
IUPAC Name: [1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane | CAS Registry Number: 98327-87-8
Synonyms: 76189-55-4, (R)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, 2,2'-BIS(DIPHENYLPHOSPHINO)-1,1'-BINAPHTHYL, (R)-(+)-BINAP, (S)-(-)-BINAP, 76189-56-5, (+/-)-BINAP, rac-BINAP, BINAP, (S)-(-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (+/-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (S)-BINAP, (R)-2,2'-bis(Diphenylphosphino)-1,1'-binaphthyl, (S)-(+)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthyl, (S)-(-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, (S)-(-)-2,2'-Bis(diphenylphosphosino)-1,1'-binaphthyl, 2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, 2,2'-Bis-diphenylphosphanyl-[1,1']binaphthalenyl, (+/-)-2,2'-Bis(diphenylphosphino)-1,1'-binaphthalene, (R)-(+)-2,2'-Bis(diphenylphosphino)-1'1-binaphthyl

Molecular Formula: C44H32P2Molecular Weight: 622.672404 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: MUALRAIOVNYAIW-UHFFFAOYSA-N

• Biphenyl-3-carboxylic acid
IUPAC Name: 3-phenylbenzoic acid | CAS Registry Number: 716-76-7
Synonyms: Diphenyl-3-carboxylic acid, 3-phenylbenzoic acid, 3-BIPHENYLCARBOXYLIC ACID, WLN: QVR CR, (1,1'-Biphenyl)-3-carboxylic acid, [1,1'-Biphenyl]-3-carboxylic acid, BM082, NSC 178898, NSC 408030, BRN 1868625, NSC178898, NSC408030, LS-44241, TL8005024, (1,1'-Biphenyl)-3-carboxylic acid (9CI), 4-09-00-02478 (Beilstein Handbook Reference), AE-641/02442054

Molecular Formula: C13H10O2Molecular Weight: 198.217300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XNLWJFYYOIRPIO-UHFFFAOYSA-N

• Bis(2-diphenylphosphinophenyl)ether
IUPAC Name: [2-(2-diphenylphosphanylphenoxy)phenyl]-diphenylphosphane | CAS Registry Number: 166330-10-5
Synonyms: DPEphos, (Oxydi-2,1-phenylene)bis(diphenylphosphine), Bis(2-diphenylphosphinophenyl) ether, Bis[2-(diphenylphosphino)phenyl] Ether, 2,2'-Bis(diphenylphosphino)diphenyl Ether, AG-E-15835, AC1N7WAS, ACMC-209du1, KSC491K0L, 510017_ALDRICH, CTK3J1505, MolPort-003-902-376, ACT03393, ANW-22199, RW2276, AKOS015900271, AC-7394, AM84570, Bis[(2-diphenylphosphino)phenyl] ether, GC10226

Molecular Formula: C36H28OP2Molecular Weight: 538.554444 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RYXZOQOZERSHHQ-UHFFFAOYSA-N

• Bis(2-methoxyethyl)aminosulfur Trifluoride
IUPAC Name: 2-methoxy-N-(2-methoxyethyl)-N-(trifluoro-$l^{4}-sulfanyl)ethanamine | CAS Registry Number: 202289-38-1
Synonyms: Bis(2-methoxyethyl)aminosulfur trifluoride, Deoxo-Fluor, Deoxo-Fluor(R), BAST, Deoxo-Fluor solution, Bis(2-methoxyethyl)aminosulphurtrifluoride, Deoxo-Fluor(R) solution, Bis(2-methoxyethyl)aminosulfur trifluoride solution, BIS(2-METHOXYETHYL)AMINOSULPHUR TRIFLUORIDE, BIS(2-METHOXYETHYL)(TRIFLUOROSULPHANYL)AMINE, [Bis(2-methoxyethyl)amino]sulfur trifluoride, Bis(2-methoxyethyl)amino-sulfur trifluoride solution, ACMC-1CFFX, AC1MC1PH, KSC205I9J, 94324_ALDRICH, 94327_ALDRICH, 494119_ALDRICH, 94324_FLUKA, 94327_FLUKA

Molecular Formula: C6H14F3NO2SMolecular Weight: 221.241070 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: APOYTRAZFJURPB-UHFFFAOYSA-N

• BMS-599626 (CAS: 8173837-23-1)
• BMS777607
IUPAC Name: N-[4-(2-amino-3-chloropyridin-4-yl)oxy-3-fluorophenyl]-4-ethoxy-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide | CAS Registry Number: 1196681-44-3
Synonyms: BMS-777607, BMS 777607, 1025720-94-8, N-(4-(2-Amino-3-chloropyridin-4-yloxy)-3-fluorophenyl)-4-ethoxy-1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxamide, BMS777607, BMS-777607, BMS 777607, S1561_Selleck, UNII-A3MMS6HDO1, SureCN2588311, cc-417, CHEMBL460702, 3f82, MolPort-016-633-238, DNC009048, BCP9000432, CS-0227, EX-7213, QC-7244, RL00120, RL00767, NCGC00263157-01

Molecular Formula: C25H19ClF2N4O4Molecular Weight: 512.892566 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: VNBRGSXVFBYQNN-UHFFFAOYSA-N

• Boc-4-Aminohexahydro-4h-Azepine
IUPAC Name: tert-butyl N-[(4S)-azepan-1-ium-4-yl]carbamate | CAS Registry Number: 196613-57-7
Synonyms: ZINC04202945

Molecular Formula: C11H23N2O2+Molecular Weight: 215.312520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MIYUNZAWHSSBPU-VIFPVBQESA-O

• Bortezomib
IUPAC Name: [(1R)-3-methyl-1-[[(2S)-3-phenyl-2-(pyrazine-2-carbonylamino)propanoyl]amino]butyl]boronic acid | CAS Registry Number: 179324-69-7
Synonyms: Velcade, Pyz-Phe-boroLeu, Velcade (TN), DPBA, PROSCRIPT BORONIC ACID, Bortezomib (JAN/USAN/INN), PS-341, Ps 341, LDP-341, LPD 341, LPD-341, MLN-341, AIDS004352, AIDS-004352, CID387447, NSC681239, NSC-681239, NCI60_029010, D03150, BO2

Molecular Formula: C19H25BN4O4Molecular Weight: 384.237200 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: GXJABQQUPOEUTA-RDJZCZTQSA-N

• Brivanib
IUPAC Name: (2R)-1-[4-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]oxypropan-2-ol | CAS Registry Number: 649735-46-6
Synonyms: UNII-DDU33B674I, CHEBI:443041, BMS540215, AC-5252, BMS 540215, CID11234052, CID 11234052, (R)-1-(4-(4-Fluoro-2-methyl-1H-indol-5-yloxy)-5-methylpyrrolo(2,1-f)(1,2,4)triazin-6-yloxy)propan-2-ol, (R)-1-(4-(4-fluoro-2-methyl-1H-indol-5-yloxy)-5-methylpyrrolo[1,2-f][1,2,4]triazin-6-yloxy)propan-2-ol, (R)-1-(4-(4-fluoro-2-methyl-1H-indol-5-yloxy)-5-methylpyrrolo[2,1-f][1,2,4]triazin-6-yloxy)propan-2-ol, 2-Propanol, 1-((4-((4-fluoro-2-methyl-1H-indol-5-yl)oxy)-5-methylpyrrolo(2,1-f)(1,2,4)triazin-6-yl)oxy)-, (2R)-

Molecular Formula: C19H19FN4O3Molecular Weight: 370.377563 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: WCWUXEGQKLTGDX-LLVKDONJSA-N

• BSI-401
IUPAC Name: 5-iodo-6-nitrochromen-2-one | CAS Registry Number: 142404-10-2
Synonyms: SCHEMBL999018, BSI401, BSI 401, BSI-401/BSI401, 5-iodo-6-nitro-2H-chromen-2-one, ABP000422, 2H-1-Benzopyran-2-one, 5-iodo-6-nitro-

Molecular Formula: C9H4INO4Molecular Weight: 317.036830 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: FXIZMDFKRKHHGE-UHFFFAOYSA-N

• Bufalin
IUPAC Name: 5-[(3S,5R,10S,13R,14S,17R)-3,14-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one | CAS Registry Number: 465-21-4
Synonyms: bufalin, NSC 89595, C24H34O4, CID10061, BRN 5141601, 3,14-Dihydroxy-bufa-20,22-dienolide, LS-45286, 3-beta,14-Dihydroxy-5-beta-bufa-20,22-dienolide, 5-beta-BUFA-20,22-DIENOLIDE, 3-beta,14-DIHYDROXY-, 5beta-Bufa-20,22-dienolide, 3beta,14-dihydroxy-, 5beta-Bufa-20,22-dienolide, 3beta,14-dihydroxy- (8CI), Bufa-20,22-dienolide, 3,14-dihydroxy-, (3beta,5beta)-, Bufa-20,22-dienolide, 3,14-dihydroxy-, (3-beta,5-beta)-, Bufa-20,22-dienolide, 3,14-dihydroxy-, (3-beta,5-beta)- (9CI), Bufa-20,22-dienolide, 3,14-dihydroxy-, (3beta,5beta)- (9CI)

Molecular Formula: C24H34O4Molecular Weight: 386.524360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QEEBRPGZBVVINN-ZXRSHIDQSA-N

• Buparlisib
IUPAC Name: 5-(2,6-dimorpholin-4-ylpyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine | CAS Registry Number: 944396-07-0
Synonyms: BKM120, BKM 120, NVP-BKM120, NVP-BKM-120, CHEMBL2017974, CHEBI:71954, BKM-120, 5-(2,6-dimorpholinopyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine, 5-[2,6-Di(4-morpholinyl)-4-pyrimidinyl]-4-(trifluoromethyl)-2-pyridinamine, 1202777-78-3, BKM120, BKM-120|, 5-[2,6-Di(Morpholin-4-Yl)pyrimidin-4-Yl]-4-(Trifluoromethyl)pyridin-2-Amine, Buparlisib [INN], S2247_Selleck, 3sd5, SureCN146956, QCR-4, UNII-0ZM2Z182GD, BKM 120NX, BKM120-NX

Molecular Formula: C18H21F3N6O2Molecular Weight: 410.393550 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 11

InChIKey: CWHUFRVAEUJCEF-UHFFFAOYSA-N

• C-1311
Synonyms: Imidacrine, XLS-002, NSC-645809, Symadex, Imidazoacridinone, XF-02, Imidazoacridone dihydrocheloride hydrate, 5-((2-(diethylamino)ethyl)amino)-8-hydroxy-6H-imidazo[4,5,1-de]acridin-6-one dihydrochloride hydrate

Molecular Formula: C20H26Cl2N4O3Molecular Weight: 441.351440 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 6

InChIKey: XJYNBZQTAZDMHZ-UHFFFAOYSA-N

• Camostat mesylate
IUPAC Name: [4-[2-[2-(dimethylamino)-2-oxoethoxy]-2-oxoethyl]phenyl] 4-(diaminomethylideneamino)benzoate; methanesulfonic acid | CAS Registry Number: 59721-29-8
Synonyms: Foipan, camostat mesilate, Foipan (TN), Camostat mesilate (JP15), Camostat monomethanesulfonate, FOY-305, D01766, 4-(2-{[2-(dimethylamino)-2-oxoethyl]oxy}-2-oxoethyl)phenyl 4-{[amino(imino)methyl]amino}benzoate methanesulfonate

Molecular Formula: C21H26N4O8SMolecular Weight: 494.518140 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 11

InChIKey: FSEKIHNIDBATFG-UHFFFAOYSA-N

• Canagliflozin
IUPAC Name: (2S,3R,4R,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-3,4,5-triol | CAS Registry Number: 842133-18-0
Synonyms: Invokana, UNII-6S49DGR869, CHEBI:73274, TA 7284, Canagliflozin hydrate, TA-7284, JNJ-28431754, 1-(Glucopyranosyl)-4-methyl-3-(5-(4-fluorophenyl)-2-thienylmethyl)benzene, D-Glucitol, 1,5-anhydro-1-C-[3-[[5-(4-fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-, (1S)-, JNJ-24831754-ZAE, JNJ-28431754-AAA, (1S)-1,5-Anhydro-1-(3-((5-(4-fluorophenyl)-2-thienyl)methyl)-4-methylphenyl)-D-glucitol, (1S)-1,5-anhydro-1-(3-{[5-(4-fluorophenyl)-2-thienyl]methyl}-4-methylphenyl)-D-glucitol, (1s)-1,5-anhydro-1-c-(3-((5-(4-fluorophenyl)-2-thienyl)methyl)-4-methylphenyl)-d-glucitol, (1S)-1,5-Anhydro-1-C-[3-[[5-(4-fluorophenyl)-2-thienyl]methyl]-4-methylphenyl]-D-glucitol, Canagliflozin anhydrous, SureCN157162, cc-209, GLU008, CHEMBL2048484

Molecular Formula: C24H25FO5SMolecular Weight: 444.515703 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: XTNGUQKDFGDXSJ-ZXGKGEBGSA-N

• Candesartan
IUPAC Name: 2-ethoxy-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylic acid | CAS Registry Number: 139481-59-7
Synonyms: candesartan, Blopress, Blopress (TN), Candesartan [BAN], Candesartan cilexetil, Candesartan [USAN:INN], Candesartan (USAN/INN), CHEBI:3347, C24H20N6O3, CV 11974, CV-11974, CV11974, DB00796, NCGC00167474-01, LS-32740, SL-00802, TL8000897, C07468, D00522, C081643

Molecular Formula: C24H20N6O3Molecular Weight: 440.454000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 9

InChIKey: HTQMVQVXFRQIKW-UHFFFAOYSA-N

• Candesartan Cilexetil
IUPAC Name: 1-cyclohexyloxycarbonyloxyethyl 2-ethoxy-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]benzimidazole-4-carboxylate | CAS Registry Number: 145040-37-5
Synonyms: Atacand, Candesartan cilexetil, Blopress, Parapres, Kenzen, Amias, Ratacand, Candesartan hexetil, Atacand (TN), Candesartan celexetil, ATACAND HCT, Blopress 16 mg Plus, Spectrum_001707, Spectrum2_000485, Spectrum3_000996, Spectrum4_001124, Spectrum5_001462, TCV-116, Candesartan cilexetil [USAN], TCV 116

Molecular Formula: C33H34N6O6Molecular Weight: 610.659660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 12

InChIKey: GHOSNRCGJFBJIB-UHFFFAOYSA-N

• Cangrelor
IUPAC Name: [dichloro-[[[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-(2-methylsulfanylethylamino)-2-(3,3,3-trifluoropropylsulfanyl)purin-9-yl]oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]methyl]phosphonic acid | CAS Registry Number: 163706-06-7
Synonyms: AR-C69931XX, Cangrelor (USAN/INN), Cangrelor [USAN:INN:BAN], UNII-6AQ1Y404U7, cangrelor (AR-C69931MX), CHEMBL334966, AR C67085MX, CHEBI:317548, D03359, (Dichloromethylene)diphosphonic N-(2-(methylsulfanyl)ethyl)-2-((3,3,3-trifluoropropyl)sulfanyl-5'-adenylic monoanhydride, [dichloro-[[[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-(2-methylsulfanylethylamino)-2-(3,3,3-trifluoropropylsulfanyl)purin-9-yl]oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]methyl]phosphonic acid, 5'-Adenylic acid, N-(2-(methylthio)ethyl)-2-((3,3,3-trifluoropropyl)thio)-, monoanhydride with (dichloromethylene)bis(phosphonic acid)

Molecular Formula: C17H25Cl2F3N5O12P3S2Molecular Weight: 776.359196 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 21

InChIKey: PAEBIVWUMLRPSK-IDTAVKCVSA-N

• Capecitabine
IUPAC Name: pentyl N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methyloxolan-2-yl]-5-fluoro-2-oxopyrimidin-4-yl]carbamate | CAS Registry Number: 154361-50-9
Synonyms: Xeloda, CAPECITABINE, Capecitabine [USAN], Xeloda (TN), Capecitabine (JAN/USAN/INN), C15H22FN3O6, Ro 09-1978, DB01101, Ro-09-1978, LS-59070, N(4)-Pentyloxycarbonyl-5'-deoxy-5-fluorocytidine, Ro 09-1978/000, R-340, 5'-Deoxy-5-fluoro-N-((pentyloxy)carbonyl)cytidine, C12650, D01223, C110904, Cytidine, 5'-deoxy-5-fluoro-N-((pentyloxy)carbonyl)-, Pentyl 1-(5-deoxy-beta-D-ribofuranosyl)-5-fluoro-1,2-dihydro-2-oxo-4-pyrimidinecarbamate, Carbamic acid, (1-(5-deoxy-beta-D-ribofuranosyl)-5-fluoro-1,2-dihydro-2-oxo-4-pyrimidinyl)-, pentyl ester

Molecular Formula: C15H22FN3O6Molecular Weight: 359.350083 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: GAGWJHPBXLXJQN-UORFTKCHSA-N

• CARBAMIC ACID (HEXAHYDRO-1H-AZEPIN-4-YL)-,TERT-BUTYL ESTER
IUPAC Name: tert-butyl N-(azepan-4-yl)carbamate | CAS Registry Number: 454451-28-6
Synonyms: AmbagaB27933, 4-(N-Boc-amino)-1H-Azepine, Boc-4-aminohexahydro-4H-azepine, MolPort-000-001-610, Tert-butyl N-(azepan-4-yl)carbamate, AC-4611, CID4645994, B52040

Molecular Formula: C11H22N2O2Molecular Weight: 214.304580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: MIYUNZAWHSSBPU-UHFFFAOYSA-N

• Carfilzomib
IUPAC Name: (2S)-4-methyl-N-[(2S)-1-[[(2S)-4-methyl-1-[(2R)-2-methyloxiran-2-yl]-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-2-[[(2S)-2-[(2-morpholin-4-ylacetyl)amino]-4-phenylbutanoyl]amino]pentanamide | CAS Registry Number: 868540-17-4
Synonyms: Carfilzomib (INN/USAN), CHEBI:620664, PR-171, CID11556711, CID 11556711, D08880

Molecular Formula: C40H57N5O7Molecular Weight: 719.909880 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: BLMPQMFVWMYDKT-NZTKNTHTSA-N

• Cilostazol
IUPAC Name: 6-[4-(1-cyclohexyltetrazol-5-yl)butoxy]-3,4-dihydro-1H-quinolin-2-one | CAS Registry Number: 73963-72-1
Synonyms: cilostazol, Pletal, Pletaal, Cilostazole, Pletal (TN), Cilostazolum [INN-Latin], Cilostazol [INN:JAN], Tocris-1692, Spectrum2_001118, Spectrum3_001170, Spectrum4_000772, Spectrum5_001762, Lopac-C-0737, OPC 21, Otsuka brand of cilostazol, Lopac0_000218, OPC-13013, BSPBio_002759, KBioGR_001184, Pharmacia brand of cilostazol

Molecular Formula: C20H27N5O2Molecular Weight: 369.460680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: RRGUKTPIGVIEKM-UHFFFAOYSA-N

• Cis-2-Benzyloctahydropyrrolo[3,4-C]Pyrrole
IUPAC Name: (3aR,6aS)-2-benzyl-3,3a,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole | CAS Registry Number: 172739-04-7
Synonyms: AmbTiB50760, CID1514450, 7-benzyl-3,7-diazabicyclo[3.3.0]octane, cis-2-Benzyloctahydropyrrolo[3,4-c]pyrrole, B50760

Molecular Formula: C13H18N2Molecular Weight: 202.295420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: AOBSJQWEYXEPBK-BETUJISGSA-N

• Cis-2-Boc-Hexahydropyrrolo[3,4-C]pyrrole
IUPAC Name: tert-butyl (3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-2-ium-5-carboxylate | CAS Registry Number: 250275-15-1
Synonyms: ZINC04203029, ZINC16697164

Molecular Formula: C11H21N2O2+Molecular Weight: 213.296640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FYUVLZRRIRGSTE-DTORHVGOSA-O

• Cisatracurium besylate
IUPAC Name: benzenesulfonate; benzenesulfonate; 5-[3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoyloxy]pentyl 3-[(1R,2R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoate | CAS Registry Number: 96946-42-8
Synonyms: Nimbex, Cisatracurium, Nimbium, Cisatracurium besilate, Benzenesulfonate, Nimbex Forte, Nimbex (TN), Cisatracurium besilate (INN), Cisatracurium besylate (USAN), NIMBEX PRESERVATIVE FREE, Cisatracurium besylate [USAN:BAN], 51W89, Atracurium besylate 1R-cis,1R'-cis form, C53H72N2O12.2C6H5O3S, DB00565, (1R-cis,1'R-cis)-Atracurium besylate, NCGC00017127-01, CAS-64228-81-5, LS-178337, TL8006016

Molecular Formula: C65H82N2O18S2Molecular Weight: 1243.479180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 18

InChIKey: XXZSQOVSEBAPGS-DONVQRBFSA-L

• 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: C10H12ClN5O3Molecular Weight: 285.686980 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: PTOAARAWEBMLNO-KVQBGUIXSA-N

• Clofarabine
IUPAC Name: (2R,3R,4S,5R)-5-(6-amino-2-chloropurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol | CAS Registry Number: 123318-82-1
Synonyms: Clolar, Clofarex, Evoltra, Clofarabine [USAN], CAFdA, Clolar (TN), C1-F-Ara-A, Clofarabine (USAN/INN), 2-Cl-2'-F-araA, STOCK1N-71250, DB00631, LS-126466, D03546, 3S211048, 2-Chloro-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)adenine, 2-Chloro-9-(2-deoxy-2-fluoro-b-D-arabinofuranosyl)-9H-purin-6-amine, 9H-Purin-6-amine, 2-chloro-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-, 2-Chloro-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-9H-purin-6-amine, CFB, (2R,3R,4S,5R)-5-(6-amino-2-chloropurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol

Molecular Formula: C10H11ClFN5O3Molecular Weight: 303.677443 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: WDDPHFBMKLOVOX-AYQXTPAHSA-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: C16H16ClNO2SMolecular Weight: 321.821740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: GKTWGGQPFAXNFI-HNNXBMFYSA-N

• Coenzyme Q10
IUPAC Name: 2-[(2E,6E,10E,14E,18E,22E,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl]-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione | CAS Registry Number: 303-98-0
Synonyms: ubidecarenone, Ubiquinone 50, ubiquinone-10, Justquinon, Neuquinon, Emitolon, Heartcin, Inokiten, Ubiquinone 10, Udekinon, Terekol, ubisemiquinone, Neuquinone, Luvacor, Adelir, Coenzyme Q, Ubiquinone, Armolipid, Mitocor, Ubiquinone Q10

Molecular Formula: C59H90O4Molecular Weight: 863.343500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: ACTIUHUUMQJHFO-UPTCCGCDSA-N

• Conivapten
IUPAC Name: N-[4-(2-methyl-4,5-dihydro-3H-imidazo[4,5-d][1]benzazepine-6-carbonyl)phenyl]-2-phenylbenzamide | CAS Registry Number: 210101-16-9
Synonyms: Conivaptan, Conivaptan (INN), Conivaptan [INN], Conivaptan hydrochloride, UNII-0NJ98Y462X, CHEBI:681850, MolPort-005-940-873, YM 087, YM087, CID151171, PDSP1_001735, PDSP2_001718, ZINC12503187, DB00872, LS-187117, D07748, L001073, L001531, (1,1'-Biphenyl)-2-carboxamide, N-(4-(4,5-dihydro-2-methylimidazo(4,5-d)(1)benzazepin-6(1H)-yl)carbonyl)phenyl)-, 4'-((4,5-dihydro-2-methylimidazo(4,5-d)(1)benzazepin-6(1H)-yl)carbonyl)-2-biphenylcarboxanilide

Molecular Formula: C32H26N4O2Molecular Weight: 498.574440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IKENVDNFQMCRTR-UHFFFAOYSA-N

• Corey Lactone
IUPAC Name: [(3aR,4S,5R,6aS)-4-(hydroxymethyl)-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] benzoate | CAS Registry Number: 39746-00-4
Synonyms: nchembio.128-comp28b, ZINC04261955, TL8002869, (3aR,4S,5R,6aS)-5-(Benzoyloxy)hexahydro-4-(hydroxymethyl)-2H-cyclopentafuran-2-one, 2H-Cyclopenta[b]furan-2-one, 5-(benzoyloxy)hexahydro-4-(hydroxymethyl)-, (3aR,4S,5R,6aS)-

Molecular Formula: C15H16O5Molecular Weight: 276.284540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: OBRRYUZUDKVCOO-FVCCEPFGSA-N

• CP-547632
IUPAC Name: 3-[(4-bromo-2,6-difluorophenyl)methoxy]-5-(4-pyrrolidin-1-ylbutylcarbamoylamino)-1,2-thiazole-4-carboxamide | CAS Registry Number: 252003-65-9
Synonyms: CID9811611, CID 9811611, CP 547632, CP-547,632, 3-(4-Bromo-2,6-difluorobenzyloxy)-5-(3-(4-pyrrolidin-1-ylbutyl)ureido)isothiazole-4-carboxylic acid amide, 4-Isothiazolecarboxamide, 3-((4-bromo-2,6-difluorophenyl)methoxy)-5-((((4-(1-pyrrolidinyl)butyl)amino)carbonyl)amino)-

Molecular Formula: C20H24BrF2N5O3SMolecular Weight: 532.402066 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: HXHAJRMTJXHJJZ-UHFFFAOYSA-N


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