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

1 to 50 of 721 Products/Chemicals (Click for related suppliers)  Page: [1] 2 3 4 5 6 7 8 9 10 11 12 13 14 15 >> Next 50 Results
• a-Methyl-L-proline
IUPAC Name: 2-methylpyrrolidine-2-carboxylic acid | CAS Registry Number: 42856-71-3
Synonyms: 2-Methylproline, alpha-Methylproline, L-Proline, 2-methyl-, NSC14964, NSC 14964, 2-Methyl-pyrrolidine-2-carboxylic acid

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: LWHHAVWYGIBIEU-UHFFFAOYSA-N

• Abiraterone
IUPAC Name: (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 154229-19-3
Synonyms: UNII-G819A456D0, CHEBI:522175, CID132971, ZINC03797541, CB 7598, CB-7598, 17-(3-Pyridyl)androsta-5,16-dien-3beta-ol, Androsta-5,16-dien-3-ol, 17-(3-pyridinyl)-, (3beta)-, (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-(pyridin-3-yl)-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Molecular Formula: C24H31NOMolecular Weight: 349.509040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GZOSMCIZMLWJML-VJLLXTKPSA-N

• ABT 737
IUPAC Name: 4-[4-[[2-(4-chlorophenyl)phenyl]methyl]piperazin-1-yl]-N-[4-[[(2R)-4-(dimethylamino)-1-phenylsulfanylbutan-2-yl]amino]-3-nitrophenyl]sulfonylbenzamide | CAS Registry Number: 852808-04-9
Synonyms: ABT-737, ABT737, 4-[4-[(4'-Chloro[1,1'-biphenyl]-2-yl)methyl]-1-piperazinyl]-N-[[4-[[(1R)-3-(dimethylamino)-1-[(phenylthio)methyl]propyl]amino]-3-nitrophenyl]sulfonyl]benzamide, Benzamide, 4-[4-[(4'-chloro[1,1'-biphenyl]-2-yl)methyl]-1-piperazinyl]-N-[[4-[[(1R)-3-(dimethylamino)-1-[(phenylthio)methyl]propyl]amino]-3-nitrophenyl]sulfonyl]-, 2yxj, 4-{4-[(4'-chlorobiphenyl-2-yl)methyl]piperazin-1-yl}-N-{[4-({(1R)-3-(dimethylamino)-1-[(phenylsulfanyl)methyl]propyl}amino)-3-nitrophenyl]sulfonyl}benzamide, S1002_Selleck, PubChem20162, SureCN158942, UNII-Z5NFR173NV, cc-242, CHEMBL376408, QCR-51, N-Benylpiperazine derivative, 2, ABP000128, DNC007115, AKOS016003299, AM81254, CS-0014, ABT-737-Supplied by Selleck Chemicals

Molecular Formula: C42H45ClN6O5S2Molecular Weight: 813.426900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: HPLNQCPCUACXLM-PGUFJCEWSA-N

• ABT-263
IUPAC Name: 4-[4-[[2-(4-chlorophenyl)-5,5-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-N-[4-[[(2R)-4-morpholin-4-yl-1-phenylsulfanylbutan-2-yl]amino]-3-(trifluoromethylsulfonyl)phenyl]sulfonylbenzamide | CAS Registry Number: 923564-51-6
Synonyms: ABT 263, CHEBI:608147, 1000696-69-4, 4-(4-{[2-(4-chlorophenyl)-5,5-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-N-({4-({(1R)-3-morpholin-4-yl-1-[(phenylsulfanyl)methyl]propyl}amino)-3-[(trifluoromethyl)sulfonyl]phenyl}sulfonyl)benzamide, Benzamide, 4-(4-((2-(4-chlorophenyl)-5,5-dimethyl-1-cyclohexen-1-yl)methyl)-1-piperazinyl)-N-((4-(((1R)-3-(4-morpholinyl)-1-((phenylthio)methyl)propyl)amino)-3-((trifluoromethyl)sulfonyl)phenyl)sulfonyl)-

Molecular Formula: C47H55ClF3N5O6S3Molecular Weight: 974.612710 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 13

InChIKey: JLYAXFNOILIKPP-KXQOOQHDSA-N

• ABT-869 (Linifanib)
IUPAC Name: 1-[4-(3-amino-1H-indazol-4-yl)phenyl]-3-(2-fluoro-5-methylphenyl)urea | CAS Registry Number: 796967-16-3
Synonyms: ABT-869, ABT 869, CHEBI:471147, CID11485656, EC-000.2119, N-(4-(3-Amino-1H-indazol-4-yl)phenyl)-N'-(2-fluoro-5-methylphenyl)urea, 1-(4-(3-amino-1H-indazol-4-yl)phenyl)-3-(2-fluoro-5-methylphenyl)urea, N-(4-(3-Amino-1H-indazol-4-yl)phenyl)-N1-(2-fluoro-5-methylphenyl)urea, N-[4-(3-amino-1H-indazol-4-yl)phenyl]-N'-(2-fluoro-5-methylphenyl)urea, Urea, N-(4-(3-amino-1H-indazol-4-yl)phenyl)-N'-(2-fluoro-5-methylphenyl)-

Molecular Formula: C21H18FN5OMolecular Weight: 375.398923 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: MPVGZUGXCQEXTM-UHFFFAOYSA-N

• AC220
IUPAC Name: 1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[4-[6-(2-morpholin-4-ylethoxy)imidazo[2,1-b][1,3]benzothiazol-2-yl]phenyl]urea | CAS Registry Number: 950769-58-1
Synonyms: Quizartinib, AC-220, AC 220, AC010220, AC-220, AC220, AC220,Quizartinib, S1526_Selleck, AC220 - Quizartinib, SureCN72923, Quizartinib (USAN/INN), Quizartinib [USAN:INN], cc-62, UNII-7LA4O6Q0D3, CHEMBL576982, CHEBI:673133, BCPP000443, HMS3244K09, HMS3244K10, HMS3244L09, HMS3265G09

Molecular Formula: C29H32N6O4SMolecular Weight: 560.667180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: CVWXJKQAOSCOAB-UHFFFAOYSA-N

• Acteoside
IUPAC Name: [(2R,3R,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | CAS Registry Number: 61276-17-3
Synonyms: Verbascoside, Kusaginin, MLS002473233, TJC 160, AIDS030638, NSC 603831, AIDS-030638, C29H36O15, NSC603831, CID5281800, LS-71509, SMR001397320, C10501, (B864379), Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-beta-D-, .beta.-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl3-O-(6-deoxy-.alpha.-L-mannopyranosyl)-, 4-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoate], 22323-52-0, 27625-92-9, Glucopyranoside, 2-(3,4-dihydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L-mannopyranosyl)-,4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-beta-D-

Molecular Formula: C29H36O15Molecular Weight: 624.587140 [g/mol]
H-Bond Donor: 9H-Bond Acceptor: 15

InChIKey: FBSKJMQYURKNSU-ZLSOWSIRSA-N

• Adapalene
IUPAC Name: 6-[3-(1-adamantyl)-4-methoxyphenyl]naphthalene-2-carboxylic acid | CAS Registry Number: 106685-40-9
Synonyms: ADAPALENE, Differin, Differin (TN), Adapalenum [INN-Latin], Adapaleno [INN-Spanish], Ambap2675, Adapalene [USAN:BAN:INN], Adapalene (JAN/USAN/INN), MLS000759463, CHEBI:31174, CD 271, CD271, C28H28O3, CD-271, DB00210, NCGC00164617-01, CPD000466349, SAM001246663, SMR000466349, LS-172017

Molecular Formula: C28H28O3Molecular Weight: 412.520120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LZCDAPDGXCYOEH-UHFFFAOYSA-N

• Adenosine 5'-monophosphate disodium salt
IUPAC Name: disodium [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate | CAS Registry Number: 4578-31-8
Synonyms: Disodium AMP, AMP disodium salt, Disodium 5'-AMP, 5'-adenylic acid, nchem.100-comp5, 5'-AMP disodium salt, Adenylic acid disodium salt, 5'-adenosine monophosphate, 5'-AMP-Na2, A1752_SIGMA, 01930_FLUKA, EINECS 224-961-2, Disodium adenosine 5'-phosphate hydrate, 5'-ADENYLIC ACID, DISODIUM SALT, A-5'-P, Adenosine 5'-monophosphate sodium salt, LS-15197, ST5409940, TL8003181, AMP

Molecular Formula: C10H12N5Na2O7PMolecular Weight: 391.184881 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 12

InChIKey: QGXLVXZRPRRCRP-IDIVVRGQSA-L

• ADERBASIB
IUPAC Name: methyl (5S,6S)-5-(hydroxycarbamoyl)-6-(4-phenylpiperazine-1-carbonyl)-7-azaspiro[2.5]octane-7-carboxylate | CAS Registry Number: 791828-58-5
Synonyms: Aderbasib, Aderbasib (USAN/INN), UNII-V9YL6NEJ3G, INCB7839, D09320

Molecular Formula: C21H28N4O5Molecular Weight: 416.470820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: DJXMSZSZEIKLQZ-IRXDYDNUSA-N

• Afimoxifene
IUPAC Name: 4-[(Z)-1-[4-(2-dimethylaminoethyloxy)phenyl]-2-phenylbut-1-enyl]phenol | CAS Registry Number: 68392-35-8
Synonyms: 4-Hydroxytamoxifen, Hydroxytamoxifen, Tamogel, 4-Hydroxy-tamoxifen, para-Hydroxytamoxifen, 4-Monohydroxytamoxifen, trans-4-Hydroxytamoxifen, Tamoxifen metabolite B, 4'-hydroxytamoxifen, Tamogel (TN), Afimoxifene [USAN], trans-Hydroxytamoxifen, (Z)-4-Hydroxytamoxifen, 2bj4, Afimoxifene (USAN/INN), 4-OH-TAM, 4-OHT, T176_SIGMA, Ici 79280, MLS000069742

Molecular Formula: C26H29NO2Molecular Weight: 387.513960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: TXUZVZSFRXZGTL-QPLCGJKRSA-N

• AFP-464
IUPAC Name: (2S)-2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxochromen-2-yl)-2-fluorophenyl]hexanamide;methanesulfonic acid | CAS Registry Number: 468719-52-0
Synonyms: AFP464, NSC710464, AC1L9IUY, 468719-53-1, NSC-710464, KB-74532, (2S)-2,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxochromen-2-yl)-2-fluorophenyl]hexanamide; methanesulfonic acid, 4H-1-Benzopyran-4-one,8-difluoro- 2-[3-fluoro-4-[(L-lysyl)amino]phenyl]-7-methyl-, dimethanesulfonate, Hexanamide,6-diamino-N-[4-(5-amino-6,8-difluoro-7-methyl-4-oxo-4H-1-benzopyran-2-yl)-2-fluorophenyl]-, (2S)-, dimethanesulfonate salt, L-Lysine,8-difluoro-7-methyl-4-oxo- 4H-1-benzopyran-2-yl)-2-fluorophenyl]amide, dimethanesulfonate

Molecular Formula: C23H27F3N4O6SMolecular Weight: 544.543890 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 12

InChIKey: MJVICFBYAVBBOA-ZOWNYOTGSA-N

• AG 490; (E)-2-CYANO-3-(3,4-DIHYDROPHENYL)-N-BENZYL-2-PRO PENAMIDE
IUPAC Name: (E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide | CAS Registry Number: 133550-30-8
Synonyms: Tyrphostin B42, 2-Propenamide, Tyrphostin AG 490, tyrphostin AG-490, Tyrphostin deriv. 42, Tocris-0414, BiomolKI_000025, Lopac-T-3434, Tyrphostin-?AG-?490, BiomolKI2_000033, AG490, Lopac0_001166, BSPBio_001396, MLS002153172, T3434_SIGMA, AG 490, AG-490, CHEBI:187221, MolPort-001-761-274, AIDS080808

Molecular Formula: C17H14N2O3Molecular Weight: 294.304660 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: TUCIOBMMDDOEMM-RIYZIHGNSA-N

• AG-14699
Synonyms: AG-014699, Rucaparib phosphate, PF-01367338, AG 014699, AG014699, AG-014447, AG-14447, Rucaparib, PF-01367338, AG-014447, 459868-92-9, PubChem22411, cc-55, Rucaparib AG 014699, SureCN844872, Rucaparib phosphate (USAN), AG-014699 - Rucaparib, CHEMBL2105733, AG-014447 (as free base), ABP000420, CO-338, KB-80434, AG-014699-Supplied by Selleck Chemicals

Molecular Formula: C19H21FN3O5PMolecular Weight: 421.359305 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 7

InChIKey: FCCGJTKEKXUBFZ-UHFFFAOYSA-N

• AKR 501
IUPAC Name: 1-[3-chloro-5-[[4-(4-chlorothiophen-2-yl)-5-(4-cyclohexylpiperazin-1-yl)-1,3-thiazol-2-yl]carbamoyl]pyridin-2-yl]piperidine-4-carboxylic acid | CAS Registry Number: 570406-98-3
Synonyms: AVATROMBOPAG, AKR-501, E5501, Avatrombopag [USAN], UNII-3H8GSZ4SQL, Avatrombopag (USAN/INN), CHEMBL2103883, YM477, DCL000686, YM 477, AS 1670542, D10306, E 5501, 4-Piperidinecarboxylic acid, 1-(3-chloro-5-(((4-(4-chloro-2-thienyl)-5-(4-cyclohexyl-1-piperazinyl)-2-thiazolyl)amino)carbonyl)-2-pyridinyl)-

Molecular Formula: C29H34Cl2N6O3S2Molecular Weight: 649.654660 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: OFZJKCQENFPZBH-UHFFFAOYSA-N

• Alacepril
IUPAC Name: (2S)-2-[[(2S)-1-[(2S)-3-acetylsulfanyl-2-methylpropanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid | CAS Registry Number: 74258-86-9
Synonyms: alacepril, Cetapril, aracepril, Alaceprilum [Latin], Cetapril (TN), Alacepril [INN:JAN], Ambap5418, Alacepril (JP15/INN), C20H26N2O5S, NSC 338157, CID71992, DU 1219, DU-1219, BRN 3634372, LS-105750, D01900, 1-(D-3-Acetylthio-2-methylpropanoyl)-L-prolyl-L-phenylalanine, N-(2-((S)-3-Acetylthio-2-methylpropionyl)propyl)-3-phenylalanin, L-Phenylalanine, N-(1-(3-(acetylthio)-2-methyl-1-oxopropyl)-L-prolyl)-, (S)-, N-(1-((S)-3-Mercapto-2-methylpropionyl)-L-prolyl)-3-phenyl-L-alanine acetate (ester)

Molecular Formula: C20H26N2O5SMolecular Weight: 406.495840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: FHHHOYXPRDYHEZ-COXVUDFISA-N

• Aliskiren hemifumarate
IUPAC Name: (2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methyl-2-propan-2-ylnonanamide; (2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methyl-2-propan-2-ylnonanamide; (E)-but-2-enedioic acid | CAS Registry Number: 173334-58-2
Synonyms: Tekturna, Enviage, Rasilez, Riprazo, Sprimeo, Aliskiren fumarate, Tekturna (TN), Aliskiren fumarate (JAN), SPP-100B, SPP-100, CGP-60536B, CGP-60536, D06412

Molecular Formula: C64H110N6O16Molecular Weight: 1219.588800 [g/mol]
H-Bond Donor: 10H-Bond Acceptor: 18

InChIKey: KLRSDBSKUSSCGU-KRQUFFFQSA-N

• AMG 208
IUPAC Name: 7-methoxy-4-[(6-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy]quinoline | CAS Registry Number: 1002304-34-8
Synonyms: AMG-208, 7-methoxy-4-((6-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy)quinoline, AMG208, 1002304-34-8, AMG208, AMG-208, 7-methoxy-4-({6-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}methoxy)quinoline, Triazolopyridazine, 4, S1316_Selleck, 3cd8, UNII-Y2SR66P7VM, SureCN9910136, cc-218, AMG208, CHEMBL496102, QCR-184, MolPort-016-633-199, AKOS015852294, BCP9000287, CS-0185, DB08079, RL00020

Molecular Formula: C22H17N5O2Molecular Weight: 383.402680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: HEAIZQNMNCHNFD-UHFFFAOYSA-N

• Amonafide
Synonyms: Nafidimide, Amonifide, Amonafidum, Amonafida, Quinamed, Xanafide, Benzisoquinolinedione, 5-Aminomitonafide, Amonafidum [Latin], Amonafida [Spanish], Amonafide [INN], BIDA, NCIMech_000383, NSC308847, MLS000757039, UNII-1Q8D39N37L, M-FA 142, M-FA-142, NSC-308847, CGX-571

Molecular Formula: C16H17N3O2Molecular Weight: 283.325080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: UPALIKSFLSVKIS-UHFFFAOYSA-N

• Amp-53
Synonyms: ethonafide, UNII-OCD466V4LD, CHEMBL40924, AMP-53, 1H-Dibenz(de,H)isoquinoline-1,3(2H)-dione, 2-(2-(dimethylamino)ethyl)-7-ethoxy-, 2-(2'-(Dimethylamino)ethyl)-1,2-dihydro-7-ethoxydibenz(de, H)isoquinoline-1,3-dione

Molecular Formula: C22H22N2O3Molecular Weight: 362.421680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: CQZISUJEDPJJNF-UHFFFAOYSA-N

• Amprenavir
IUPAC Name: [(3S)-oxolan-3-yl] N-[(2S,3R)-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate | CAS Registry Number: 161814-49-9
Synonyms: amprenavir, Agenerase, Prozei, Vertex, Vertex VX478, 1hpv, Amprenavir [USAN], Agenerase (TM), Agenerase (TN), GNA & Amprenavir, HHA & Amprenavir, 1t7j, VX-478, VX 478, HSDB 7157, Amprenavir (JAN/USAN/INN), DRG-0258, C25H35N3O6S, CHEBI:40050, KVX-478

Molecular Formula: C25H35N3O6SMolecular Weight: 505.626900 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 8

InChIKey: YMARZQAQMVYCKC-OEMFJLHTSA-N

• Amsilarotene
IUPAC Name: 4-[[3,5-bis(trimethylsilyl)benzoyl]amino]benzoic acid | CAS Registry Number: 125973-56-0
Synonyms: Am 555S, Am-555S, TAC-101, TAC 101, CHEBI:145921, MolPort-005-942-618, CID9800306, 4-(3,5-Bis(trimethylsilyl)benzamido) benzoic acid, 4-[[3,5-bis(trimethylsilyl)benzoyl]amino]benzoic Acid, Benzoic acid, 4-((3,5-bis(trimethylsilyl)benzoyl)amino)-, 4-(3,5-Bis-trimethylsilanyl-benzoylamino)-benzoic acid(Am555S)

Molecular Formula: C20H27NO3Si2Molecular Weight: 385.604280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: VVTNSTLJOVCBDL-UHFFFAOYSA-N

• ANV-944
IUPAC Name: [(2R)-1-cyanobutan-2-yl] N-[(1S)-1-[3-[[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]carbamoylamino]phenyl]ethyl]carbamate | CAS Registry Number: 501345-02-4
Synonyms: UNII-I3NPL1V48Q, I3NPL1V48Q, AVN944, CHEMBL3185925, AVN 944, AVN-944, VX 944, NCGC00345803-01, (R)-1-cyanobutan-2-yl ((S)-1-(3-(3-(3-methoxy-4-(oxazol-5-yl)phenyl)ureido)phenyl)ethyl)carbamate, 297730-17-7, Carbamic acid, ((1S)-1-(3-((((3-methoxy-4-(5- oxazolyl)phenyl)amino)carbonyl)amino)phenyl)ethyl)-, (1R)-1-(cyanomethyl)propyl ester

Molecular Formula: C25H27N5O5Molecular Weight: 477.512380 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: GYCPCOJTCINIFZ-OXJNMPFZSA-N

• AP24534
IUPAC Name: 3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide | CAS Registry Number: 943319-70-8
Synonyms: PONATINIB, Iclusig, AP-24534, AP-24534, Ponatinib, AP24534, AP 24534, UNII-4340891KFS, 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide, 3-(2-(Imidazo[1,2-b]pyridazin-3-yl)ethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide, BENZAMIDE, 3-(2-IMIDAZO[1,2-B]PYRIDAZIN-3-YLETHYNYL)-4-METHYL-N-[4-[(4-METHYL-1-PIPERAZINYL)METHYL]-3-(TRIFLUOROMETHYL)PHENYL]-, 0LI, 3-(Imidazo[1,2-B]pyridazin-3-Ylethynyl)-4-Methyl-N-{4-[(4-Methylpiperazin-1-Yl)methyl]-3-(Trifluoromethyl)phenyl}benzamide, S1490_Selleck, AP24534,Ponatinib, Ponatinib (USAN/INN), Ponatinib [USAN:INN], AP24534 - Ponatinib, Ponatinib (AP24534), SureCN589260, QCR-6, cc-191

Molecular Formula: C29H27F3N6OMolecular Weight: 532.559490 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: PHXJVRSECIGDHY-UHFFFAOYSA-N

• Apaziquone
IUPAC Name: 5-(aziridin-1-yl)-3-(hydroxymethyl)-2-[(E)-3-hydroxyprop-1-enyl]-1-methylindole-4,7-dione | CAS Registry Number: 114560-48-4
Synonyms: Apaziquonum, EOquin, Neoquin, Eoquin (TN), EO 9 (pharmaceutical), Apaziquonum [INN-Latin], Apaziquone (USAN/INN), Apaziquone [USAN:INN], NOR-701, UNII-H464ZO600O, EO-9, CHEBI:221457, C15H16N2O4, NSC 382456, NSC 382459, ZINC01536777, E 09, CID5813717, NSC-382456, NSC-382459

Molecular Formula: C15H16N2O4Molecular Weight: 288.298540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: MXPOCMVWFLDDLZ-NSCUHMNNSA-N

• Aprepitant
IUPAC Name: 5-[[(2S,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,2-dihydro-1,2,4-triazol-3-one | CAS Registry Number: 170729-80-3
Synonyms: Emend, Aprepitant [USAN], MK 869, MK 0869, DB00673, NCGC00181785-01, LS-156477, L 754030, 3H-1,2,4-Triazol-3-one, 5-(((2R,3S)-2-((1R)-1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)-4-morpholinyl)methyl)-1,2-dihydro-, 3H-1,2,4-Triazol-3-one, 5-((2-(1-(3,5-bis(trifluoromethyl)phenyl)ethoxy)-3-(4-fluorophenyl)-4-morpholinyl)methyl)-1,2-dihydro-, (2R-(2alpha(R*),3alpha))-, 221350-96-5, 3-(((2R,3S)-3-(p-Fluorophenyl)-2-(((alphaR)-alpha-methyl-3,5-bis(trifluoromethyl)benzyl)oxy)morpholino)methyl)-delta(sup 2)-1,2,4-triazolin-5-one, 5-[[(2S,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,2-dihydro-1,2,4-triazol-3-one

Molecular Formula: C23H21F7N4O3Molecular Weight: 534.426662 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 12

InChIKey: ATALOFNDEOCMKK-BYYRLHKVSA-N

• Apricoxib
IUPAC Name: 4-[2-(4-ethoxyphenyl)-4-methylpyrrol-1-yl]benzenesulfonamide | CAS Registry Number: 197904-84-0
Synonyms: Apricoxib (USAN/INN), UNII-5X5HB3VZ3Z, CID9820073, D08657, 2-(4-Ethoxyphenyl)-4-methyl 1-(4-sulfamoylphenyl)-1H-pyrrole, 4-[2-(4-ethoxyphenyl)-4-methyl-pyrrol-1-yl]benzenesulfonamide

Molecular Formula: C19H20N2O3SMolecular Weight: 356.438700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JTMITOKKUMVWRT-UHFFFAOYSA-N

• Aptivus
IUPAC Name: N-[3-[(1R)-1-[(2R)-6-hydroxy-4-oxo-2-phenethyl-2-propyl-3H-pyran-5-yl]propyl]phenyl]-5-(trifluoromethyl)pyridine-2-sulfonamide | CAS Registry Number: 174484-41-4
Synonyms: Tipranavir, 1d4y, 2o4l, 2o4n, 2o4p, AIDS032941, PNU-140690, AIDS-032941, CID65027, PNU-140690E, DB00932, PNU 140690, 191150-83-1 (DISODIUM SALT), U-140690, U 140690, TPV, 2-Pyridinesulfonamide, N-(3-((1R)-1-((6R)-5,6-dihydro-4-hydroxy-2-oxo-6-(2-phenylethyl)-6-propyl-2H-pyran-3-yl)propyl)phenyl)-5-(trifluoromethyl)-, 2-Pyridinesulfonamide, N-(3-(1-(5,6-dihydro-4-hydroxy-2-oxo-6-(2-phenylethyl)-6-propyl-2H-pyran-3-yl)propyl)phenyl)-5-(trifluoromethyl)-, (R-(R*,R*))-, 2-Pyridinesulfonamide, N-[3-[(1R)-1-[(6R)-5,6-dihydro-4-hydroxy-2-oxo-6-(2-phenylethyl)-6-propyl-2H-pyran-3-yl]propyl]phenyl]-5-(trifluoromethyl)-, N-(3-{(1R)-1-[(6R)-4-HYDROXY-2-OXO-6-PHENETHYL-6-PROPYL-5,6-DIHYDRO-2H-PYRAN-3-YL]PROPYL}PHENYL)-5-(TRIFLUOROMETHYL)-2-PYRIDINESULFONAMIDE

Molecular Formula: C31H33F3N2O5SMolecular Weight: 602.664330 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: NZPXPXAGXYTROM-FYBSXPHGSA-N

• Argatroban
IUPAC Name: (2R,4R)-1-[5-(diaminomethylideneamino)-2-[(3-methyl-1,2,3,4-tetrahydroquinolin-8-yl)sulfonylamino]pentanoyl]-4-methylpiperidine-2-carboxylic acid hydrate | CAS Registry Number: 141396-28-3
Synonyms: argatroban, Novastan, Argatroban hydrate, Novastan (TN), Argatroban (USAN), Argatroban hydrate (JAN), D00181

Molecular Formula: C23H38N6O6SMolecular Weight: 526.649420 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 11

InChIKey: AIEZTKLTLCMZIA-LINCPPCXSA-N

• Atorvastatin Calcium
IUPAC Name: calcium (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate | CAS Registry Number: 134523-03-8
Synonyms: Lipitor, atorvastatin, Prevencor, Lipibec, Torvast, Caduet, Sortis, Tahor, Mixture Name, ATORVASTATIN CALCIUM, Lipitor (TN), Atorvastatin calcium salt, Atorvastatin calcium [USAN], Atorvastatin calcium (USAN), 2C33H34FN2O5.Ca, CI-981, DRG-0321, CHEBI:50686, BB_SC-4721, YM-548

Molecular Formula: C66H68CaF2N4O10Molecular Weight: 1155.341726 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 14

InChIKey: FQCKMBLVYCEXJB-MNSAWQCASA-L

• Atracurium Besilate
IUPAC Name: 5-[3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoyloxy]pentyl 3-[1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propanoate | CAS Registry Number: 64228-79-1
Synonyms: Atracurium, Tracrium, Atracurium besilate, Atracurium Dibesylate, Prestwick1_000005, Prestwick2_000005, Prestwick3_000005, BSPBio_000009, SPBio_001930, BPBio1_000011, BW-33A, C53H70N2O12, CID47319, BRN 1523633, DB00732, LS-86151, AB00514743, C07548, 33 A 74, Isoquinolinium, 1,2,3,4-tetrahydro-2,2'-(1,5-pentanediylbis(oxy(3-oxo-3,1-propanediyl)))bis(1-((3,4-dimethoxyphenyl)methyl)-6,7-dimethoxy-2-methyl-

Molecular Formula: C53H72N2O12+2Molecular Weight: 929.144980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 12

InChIKey: YXSLJKQTIDHPOT-UHFFFAOYSA-N

• Atrasentan
IUPAC Name: (2R,3R,4S)-4-(1,3-benzodioxol-5-yl)-1-[2-(dibutylamino)-2-oxoethyl]-2-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid | CAS Registry Number: 173937-91-2
Synonyms: Xinlay, Atrasentan [INN], ABT-627, ABT 627, UNII-V6D7VK2215, CHEBI:105200, (11C)ABT-627, CID159594, NSC720763, A-147627, LS-184352, A-127722, C098644, (+)-A 127722, A 127722, A 147627, A-127722.5, (+)-A-127722, 3-Pyrrolidinecarboxylic acid, 4-(1,3-benzodioxo-5-yl)-1-(2-(dibutylamino)-2-oxoethyl)-2-(4-methoxyphenyl)-, (2R,3R,4S)-, 3-Pyrrolidinecarboxylic acid, 4-(1,3-benzodioxol-5-yl)-1-(2-dibutylamino)-2-oxoethyl)-2-(4-methoxyphenyl)-, (2R-(2alpha,3beta,4alpha))-

Molecular Formula: C29H38N2O6Molecular Weight: 510.621820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: MOTJMGVDPWRKOC-QPVYNBJUSA-N

• AV-412
IUPAC Name: N-[4-(3-chloro-4-fluoroanilino)-7-[3-methyl-3-(4-methylpiperazin-1-yl)but-1-ynyl]quinazolin-6-yl]prop-2-enamide | CAS Registry Number: 451492-95-8
Synonyms: AV-412 free base, UNII-41OXH4FE7B, SureCN1818495, BCPP000375, HMS3244M15, HMS3244M16, HMS3244N15, ABP000875, RS0030, BCP9000342, NCGC00263195-01, KB-69550, 2-Propenamide, N-(4-((3-chloro-4-fluorophenyl)amino)-7-(3-methyl-3-(4-methyl-1-piperazinyl)-1-butyn-1-yl)-6-quinazolinyl)-, 2-Propenamide,N-[4-[(3-chloro-4-fluorophenyl)amino]-7-[3-methyl-3-(4-methyl-1-piperazinyl)-1-butyn-1-yl]-6-quinazolinyl]-, N-(4-(3-chloro-4-fluorophenylamino)-7-(3-methyl-3-(4-methylpiperazin-1-yl)but-1-ynyl)quinazolin-6-yl)acrylamide

Molecular Formula: C27H28ClFN6OMolecular Weight: 507.002223 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: ZAJXXUDARPGGOC-UHFFFAOYSA-N

• Axitinib
IUPAC Name: N-methyl-2-[[3-[(E)-2-pyridin-2-ylethenyl]-1H-indazol-6-yl]sulfanyl]benzamide | CAS Registry Number: 319460-85-0
Synonyms: Axitinib [USAN], AG-013736, CID6450551, AG-13736, AG 013736, Benzamide, N-methyl-2-((3-((1E)-2-(2-pyridinyl)ethenyl)-1H-indazo)-6-yl)thio)-, N-methyl-2-((3-((1E)-2-(pyridin-2-yl)ethenyl)-1H-indazol-6-yl)sulfanyl)benzamide, 790713-39-2

Molecular Formula: C22H18N4OSMolecular Weight: 386.469520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: RITAVMQDGBJQJZ-FMIVXFBMSA-N

• AZD8931
IUPAC Name: 2-[4-[4-(3-chloro-2-fluoroanilino)-7-methoxyquinazolin-6-yl]oxypiperidin-1-yl]-N-methylacetamide | CAS Registry Number: 848942-61-0
Synonyms: CHEMBL2408045, AZD-8931, AZD8931, AZD 8931, Sapitinib, Sapitinib [INN], 2-(4-((4-((3-Chloro-2-fluorophenyl)amino)-7-methoxyquinazolin-6-yl)oxy)piperidin-1-yl)-n-methylacetamide, 2-[4-({4-[(3-chloro-2-fluorophenyl)amino]-7-methoxyquinazolin-6-yl}oxy)piperidin-1-yl]-N-methylacetamide, S2192_Selleck, Sapitinib [WHO-DD], SureCN202358, AGN-PC-00A3ZY, cc-427, MolPort-016-633-303, BCPP000365, AZD 8931, BCP9000357, QC-7257, RL05221, AZD8931-Supplied by Selleck Chemicals, NCGC00346573-01

Molecular Formula: C23H25ClFN5O3Molecular Weight: 473.927703 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: DFJSJLGUIXFDJP-UHFFFAOYSA-N

• 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

• 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

• Benzeneacetamide, 4-fluoro-a-(4-fluorophenyl)-a-phenyl-
IUPAC Name: 2,2-bis(4-fluorophenyl)-2-phenylacetamide | CAS Registry Number: 289656-45-7
Synonyms: Senicapoc, Senicapoc (USAN), ICA-17043, ICA 17043, LS-191067, D06640, 4-Fluoro-alpha-(4-fluorophenyl)-alpha-phenylbenzeneacetamide, Benzeneacetamide, 4-fluoro-alpha-(4-fluorophenyl)-alpha-phenyl-

Molecular Formula: C20H15F2NOMolecular Weight: 323.336006 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SCTZUZTYRMOMKT-UHFFFAOYSA-N

• Benzeneacetonitrile, 4-[2,3-dihydro-3-methyl-2-oxo-8-(3-quinolinyl)-1H-imidazo[4,5-c]quinolin-1-yl]-a,a-dimethyl-
IUPAC Name: 2-methyl-2-[4-(3-methyl-2-oxo-8-quinolin-3-ylimidazo[4,5-c]quinolin-1-yl)phenyl]propanenitrile | CAS Registry Number: 915019-65-7
Synonyms: NVP-BEZ235, BEZ235, BEZ-235, NVP-BEZ 235, BEZ 235, NVPBEZ235, 2-methyl-2-(4-(3-methyl-2-oxo-8-(quinolin-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]quinolin-1-yl)phenyl)propanenitrile, NVP BEZ235, S1009_Selleck, Kinome_2911, NVP-BEZ-235, CHEBI:71952, MolPort-005-737-784, NVP-BEZ235, BEZ235, ZINC24760115, ST51056474, 2-Methyl-2-[4-[3-methyl-2-oxo-8-(quinolin-3-yl)-2,3-dihydroimidazo[4,5-c]quinolin-1-yl]phenyl]propionitrile, S14-0511, dactolisib, 2-(4-(2,3-dihydro-3-methyl-2-oxo-8-(quinolin-3-yl)imidazo[4,5-c]quinolin-1-yl)phenyl)-2-methylpropanenitrile

Molecular Formula: C30H23N5OMolecular Weight: 469.536520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JOGKUKXHTYWRGZ-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


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