China ShengDa Pharmaceutical Company

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Profile: China ShengDa Pharmaceutical Company is an ISO 14001:2004 & ISO 9001:2000 certified company. Our product line includes tannic acid, tretinoin, minoxidil, dipyridamole, telicoplanin, and calcipotriol. We also offer hydroxypropyl methylcellulose, macromolecule, polyacrylamide, and hydroxyethylcellulose.

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• GW 788388

IUPAC Name: N-(oxan-4-yl)-4-[4-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridin-2-yl]benzamide | CAS Registry Number: 452342-67-5
Synonyms: GW788388, GW-788388, 4-(4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridin-2-yl)-N-(tetrahydro-2H-pyran-4-yl)benzamide, cc-69, SureCN373524, CHEMBL202887, CTK8C0589, CHEBI:442971, UNII-N14114957J, ANW-64933, DNC006358, AKOS016005022, BCP9000754, CS-0254, NCGC00346679-01, AK103288, HY-10326, QC-10483, BCP0726000062, X7615

Molecular Formula:	C₂₅H₂₃N₅O₂	Molecular Weight:	425.482420 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: SAGZIBJAQGBRQA-UHFFFAOYSA-N

• GW 9508; 4-[[(3-PHENOXYPHENYL)METHYL]AMINO]PHENYLPROPANOIC ACID

IUPAC Name: 3-[4-[(3-phenoxyphenyl)methylamino]phenyl]propanoic acid | CAS Registry Number: 885101-89-3
Synonyms: GW9508, GW 9508, 3-(4-(3-phenoxybenzylamino)phenyl)propanoic acid, 3-(4-((3-Phenoxybenzyl)amino)phenyl)propanoic acid, GW-9508, Benzenepropanoic acid, 4-[[(3-phenoxyphenyl)methyl]amino]-, Benzenepropanoic acid, 4-(((3-phenoxyphenyl)methyl)amino)-, AGN-PC-00CBAC, SureCN364468, UNII-4T77GYP2CS, carboxylic acid agonist, 2, cc-702, MLS001065626, CHEMBL207881, CTK8B8037, QCR-210, MolPort-009-019-206, HMS2197G09, HMS3261P03, HMS3269J09

Molecular Formula:	C₂₂H₂₁NO₃	Molecular Weight:	347.407040 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: DGENZVKCTGIDRZ-UHFFFAOYSA-N

• Gw2580, Free Base

IUPAC Name: 5-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]pyrimidine-2,4-diamine | CAS Registry Number: 870483-87-7
Synonyms: CSF-1 Receptor Inhibitor, cFMS Receptor Tyrosine Kinase Inhibitor, GW632580X, GW-2580, 5-(3-Methoxy-4-((4-methoxybenzyl)oxy)benzyl)-pyrimidine-2,4-diamine, 2,4-Pyrimidinediamine, 5-((3-methoxy-4-((4-methoxyphenyl)methoxy)phenyl)methyl)-, 2,4-Pyrimidinediamine, 5-[[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]methyl]-, Kinome_3757, 4at5, UNII-SRV0JCF9LI, AGN-PC-00CRC7, SureCN4326587, cc-705, CHEMBL261849, CTK8E8759, HMS3229E11, HMS3303G12, HMS3305H21, GW2580, IN1333

Molecular Formula:	C₂₀H₂₂N₄O₃	Molecular Weight:	366.413680 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: MYQAUKPBNJWPIE-UHFFFAOYSA-N

• H-ALA-AFC TFA

IUPAC Name: (2S)-2-amino-N-[2-oxo-4-(trifluoromethyl)chromen-7-yl]propanamide;2,2,2-trifluoroacetic acid | CAS Registry Number: 201847-57-6
Synonyms: CTK8F0619, L-Alanine 7-amido-4-(trifluoromethyl)coumarin, trifluoroacetate salt

Molecular Formula:	C₁₅H₁₂F₆N₂O₅	Molecular Weight:	414.256599 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	12

InChIKey: HAGLUJXYGFQWBT-RGMNGODLSA-N

• H-ALA-AMC

IUPAC Name: (2S)-2-amino-N-(4-methyl-2-oxochromen-7-yl)propanamide | CAS Registry Number: 77471-41-1
Synonyms: (S)-2-Amino-N-(4-methyl-2-oxo-2H-chromen-7-yl)propanamide, L-Ala-AMC, L-A-AMC, L-Ala-7-Amino-4-Methylcoumarin, AmbotzHAA1174, AC1LEMEH, (2S)-2-amino-N-(4-methyl-2-oxochromen-7-yl)propanamide, CTK8B7757, MolPort-008-267-978, ANW-58382, AKOS015893080, AG-H-10081, AK-81768, KB-01294, FT-0689958, I04-1273, (2S)-2-amino-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-Propanamide, Propanamide,2-amino-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-, (S)-; L-Alanine 4-methylcoumaryl-7-amide

Molecular Formula:	C₁₃H₁₄N₂O₃	Molecular Weight:	246.261860 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: IWSOXHMIRLSLKT-QMMMGPOBSA-N

• H-GLY-AMC

IUPAC Name: 2-amino-N-(4-methyl-2-oxochromen-7-yl)acetamide | CAS Registry Number: 77471-42-2
Synonyms: L-Gly-AMC, L-Gly-7-Amino-4-Methylcoumarin, L-G-AMC, 2-Amino-N-(4-methyl-2-oxo-2H-chromen-7-yl)acetamide, AmbotzHAA7970, AC1LEM62, SCHEMBL790969, AMC004, MolPort-008-268-104, KM1858, AKOS022186047, AJ-09671, AK144290, DA-03426, ST24039983, 2-amino-N-(4-methyl-2-oxochromen-7-yl)acetamide, 2-amino-N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)Acetamide

Molecular Formula:	C₁₂H₁₂N₂O₃	Molecular Weight:	232.235280 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: KYIPWSXYZXKCST-UHFFFAOYSA-N

• H-ILE-AMC

IUPAC Name: (2S,3S)-2-amino-3-methyl-N-(4-methyl-2-oxochromen-7-yl)pentanamide | CAS Registry Number: 98516-74-6
Synonyms: (2S,3S)-2-Amino-3-methyl-N-(4-methyl-2-oxo-2H-chromen-7-yl)pentanamide, L-Ile-AMC, L-I-AMC, L-Ile-7-Amino-4-Methylcoumarin, AmbotzHAA7690, MolPort-008-268-094, AKOS022186048, AJ-37049, AK144292, ST24034123

Molecular Formula:	C₁₆H₂₀N₂O₃	Molecular Weight:	288.341600 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: MLILEIUKVIPULY-VFZGTOFNSA-N

• H-Leu-Pna Hcl

IUPAC Name: (2S)-2-amino-4-methyl-N-(4-nitrophenyl)pentanamide;hydrochloride | CAS Registry Number: 16010-98-3
Synonyms: L-Leucine p-nitroanilide hydrochloride, (S)-2-Amino-4-methyl-N-(4-nitrophenyl)pentanamide hydrochloride, SureCN8760813, L2158_SIGMA, CTK8C0024, MolPort-003-946-354, ANW-63898, AKOS015903326, L-Leucine 4-nitroanilide hydrochloride, AM81896, AK-63433, AB1006936, FT-0688552, I14-18947, I14-37387

Molecular Formula:	C₁₂H₁₈ClN₃O₃	Molecular Weight:	287.742620 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: PFOYXOWPGRWPLS-MERQFXBCSA-N

• h-lys(boc)-pna

IUPAC Name: tert-butyl N-[(5S)-5-amino-6-(4-nitroanilino)-6-oxohexyl]carbamate | CAS Registry Number: 172422-76-3
Synonyms: AmbotzHAA1183, AC1OLRCK, H-L-Lys(Boc)-pNA, CTK8E9396, N-|A-Boc-L-lysine 4-nitroanilide, AM81967, tert-butyl N-[(5S)-5-amino-6-(4-nitroanilino)-6-oxohexyl]carbamate

Molecular Formula:	C₁₇H₂₆N₄O₅	Molecular Weight:	366.412140 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: YJTUIVMGRIFXTD-AWEZNQCLSA-N

• H-Phe-Amc Tfa

IUPAC Name: (2S)-2-amino-N-(4-methyl-2-oxochromen-7-yl)-3-phenylpropanamide;2,2,2-trifluoroacetic acid | CAS Registry Number: 108321-84-2
Synonyms: L-Phenylalanine 7-amido-4-methylcoumarin trifluoroacetate salt, L-Phenylalanine 4-methyl-7-coumarinylamide trifluoroacetate salt, 78089_FLUKA, AKOS015910343, P-3500, I14-40715

Molecular Formula:	C₂₁H₁₉F₃N₂O₅	Molecular Weight:	436.381170 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	9

InChIKey: TWTCFDQXNADDLQ-NTISSMGPSA-N

• H-PRO-AMC

IUPAC Name: (2S)-N-(4-methyl-2-oxochromen-7-yl)pyrrolidine-2-carboxamide | CAS Registry Number: 96643-94-6
Synonyms: (S)-N-(4-Methyl-2-oxo-2H-chromen-7-yl)pyrrolidine-2-carboxamide, L-Pro-AMC, L-P-AMC, L-Pro-7-Amino-4-Methylcoumarin, AmbotzHAA7730, AC1MBZMU, SCHEMBL3278475, MolPort-008-268-098, AKOS022186098, AJ-22160, AK144294, ST24036356, (2S)-N-(4-methyl-2-oxochromen-7-yl)pyrrolidine-2-carboxamide

Molecular Formula:	C₁₅H₁₆N₂O₃	Molecular Weight:	272.299140 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: HSLXTZWJAHQHHF-LBPRGKRZSA-N

• H-VAL-AMC.TFA

IUPAC Name: (2S)-2-amino-3-methyl-N-(4-methyl-2-oxochromen-7-yl)butanamide;2,2,2-trifluoroacetic acid | CAS Registry Number: 191723-67-8
Synonyms: (S)-2-Amino-3-methyl-N-(4-methyl-2-oxo-2H-chromen-7-yl)butanamide 2,2,2-trifluoroacetate, L-Valine 7-amido-4-methylcoumarin, trifluoroacetate salt, CTK8F0611, AKOS022186113, AK144169, RT-013543, ST24035994, V-2100

Molecular Formula:	C₁₇H₁₉F₃N₂O₅	Molecular Weight:	388.338370 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	9

InChIKey: YWKMFSIFKPKVAM-UQKRIMTDSA-N

• H-Val-PNA.HCL

IUPAC Name: (2S)-2-amino-3-methyl-N-(4-nitrophenyl)butanamide;hydrochloride | CAS Registry Number: 77835-49-5
Synonyms: L-Valine p-nitroanilide hydrochloride, V6005_SIGMA, CTK8G0688, L-Valine 4-nitroanilide hydrochloride, AG-H-11858, Butanamide,2-amino-3-methyl-N-(4-nitrophenyl)-, monohydrochloride, (S)-;L-Valine-4-nitroanilide hydrochloride

Molecular Formula:	C₁₁H₁₆ClN₃O₃	Molecular Weight:	273.716040 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: BGTMFJBVZIWWCC-PPHPATTJSA-N

• Hesperadin

IUPAC Name: N-[(3Z)-2-oxo-3-[phenyl-[4-(piperidin-1-ylmethyl)anilino]methylidene]-1H-indol-5-yl]ethanesulfonamide

Molecular Formula:	C₂₉H₃₂N₄O₃S	Molecular Weight:	516.654380 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: GLDSKRNGVVYJAB-DQSJHHFOSA-N

• Hesperetin

IUPAC Name: (2S)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one | CAS Registry Number: 520-33-2
Synonyms: hesperetin, Hesperitin, (-)-hesperetin, Prestwick_908, YSO2, Spectrum_000181, Prestwick0_000124, Prestwick1_000124, Prestwick2_000124, Prestwick3_000124, Spectrum2_001793, Spectrum3_001104, Spectrum4_001935, Spectrum5_000683, Oprea1_828704, BSPBio_000168, BSPBio_002808, KBioGR_002311, KBioSS_000661, SPECTRUM310012

Molecular Formula:	C₁₆H₁₄O₆	Molecular Weight:	302.278760 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: AIONOLUJZLIMTK-AWEZNQCLSA-N

• Hesperetin dihydrochalcone

IUPAC Name: 3-(3-hydroxy-4-methoxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one | CAS Registry Number: 35400-60-3
Synonyms: 1-Propanone, 3-(3-hydroxy-4-methoxyphenyl)-1-(2,4,6-trihydroxyphenyl)-, 3-(3-Hydroxy-4-methoxyphenyl)-1-(2,4,6-trihydroxyphenyl)-1-propanone

Molecular Formula:	C₁₆H₁₆O₆	Molecular Weight:	304.294640 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: RWKSTZADJBEXSQ-UHFFFAOYSA-N

• Hesperidin

IUPAC Name: (2S)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one | CAS Registry Number: 520-26-3
Synonyms: hesperidin, Cirantin, Hesperidoside, Hesperidine, Ciratin, Hesper bitabs, Hesperetin-rutinosid, Hesperidin (JAN), Hesperidin, (2S)-, Hesperetin 7-rutinoside, Hesperetin 7-O-rutinoside, Hesperetin-7-rutinoside, USAF CF-3, Hesperetin 7-rhamnoglucoside, Hesperitin-7-rhamnoglucoside, Hesperidin, (S)-(-)-, Prestwick3_000400, (S)-(--)-hesperidin, CCRIS 3940, BSPBio_000619

Molecular Formula:	C₂₈H₃₄O₁₅	Molecular Weight:	610.560560 [g/mol]
H-Bond Donor:	8	H-Bond Acceptor:	15

InChIKey: QUQPHWDTPGMPEX-QJBIFVCTSA-N

• Hexamethylphosphorous Triamide

IUPAC Name: N-[bis(dimethylamino)phosphanyl]-N-methylmethanamine | CAS Registry Number: 1608-26-0
Synonyms: Hexametapil, Hexamethylphosphorous triamide, HMPT, Hexamethyltriamidophosphite, Tris(dimethylamino)phosphine, HMPT (VAN), Phosphine, tris(dimethylamino)-, PHOSPHOROUS TRIAMIDE, HEXAMETHYL-, 393290_ALDRICH, 93338_FLUKA, EINECS 216-534-4, NSC 102707, BRN 0906778, NSC102707, ZINC00154689, AI3-19434, LS-109033, 4-04-00-00274 (Beilstein Handbook Reference), N,N,N',N',N'',N''-hexamethylphosphorous triamide, phosphorous triamide, N,N,N',N',N'',N''-hexamethyl-

Molecular Formula:	C₆H₁₈N₃P	Molecular Weight:	163.200981 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: XVDBWWRIXBMVJV-UHFFFAOYSA-N

• Hexanamide, 3-amino-N-cyclopropyl-2-hydroxy-, (3S)-

IUPAC Name: (3S)-3-amino-N-cyclopropyl-2-hydroxyhexanamide | CAS Registry Number: 402960-19-4
Synonyms: (3S)-3-Amino-N-cyclopropyl-2-hydroxyhexanamide, SureCN329193, HEX002, CTK1D4666, AK141440, FT-0660773

Molecular Formula:	C₉H₁₈N₂O₂	Molecular Weight:	186.251420 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	3

InChIKey: DRNGSSWBFKDSEE-JAMMHHFISA-N

• Homopiperazine

IUPAC Name: 1,4-diazepane | CAS Registry Number: 505-66-8
Synonyms: 1,4-Diazacycloheptane, Perhydro-1,4-diazepine, Hexahydro-1,4-diazepine, Trimethyleneethylenediamine, H16604_ALDRICH, 1H-1,4-Diazepine, hexahydro-, 53585_FLUKA, EINECS 208-016-1, BRN 0102711, SBB004367, LS-60195, 2,3,4,5,6,7-Hexahydro-1H-1,4-diazepine, 5-23-03-00240 (Beilstein Handbook Reference), InChI=1/C5H12N2/c1-2-6-4-5-7-3-1/h6-7H,1-5H

Molecular Formula:	C₅H₁₂N₂	Molecular Weight:	100.162180 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: FQUYSHZXSKYCSY-UHFFFAOYSA-N

• Idarubicin

IUPAC Name: (7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione | CAS Registry Number: 58957-92-9
Synonyms: IDARUBICIN, Idarubicina, Idamycin, Idarubicin Hcl, 4-Demethoxydaunomycin, 4-Demethoxydaunorubicin, idarubicin hydrochloride, DMDR, Idarubicine [INN-French], Idarubicinum [INN-Latin], Idarubicina [INN-Spanish], Daunomycin, 4-demethoxy-, 4-Desmethoxydaunorubicin, Idarubicin [INN:BAN], CCRIS 5083, IMI 30, IMI-30, 4-DMD, Lopac0_000600, KBioSS_002388

Molecular Formula:	C₂₆H₂₇NO₉	Molecular Weight:	497.493880 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	10

InChIKey: XDXDZDZNSLXDNA-TZNDIEGXSA-N

• Imatinib

IUPAC Name: 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide | CAS Registry Number: 152459-95-5
Synonyms: Glivec, Gleevec, Imatinib mesylate, 1iep, 1xbb, sti-571, nchembio.83-comp14, Imatinib [INN:BAN], Imatinib Methansulfonate, nchembio.117-comp23, STI 571, Cgp 57148, CGP 57148B, CCRIS 9076, STI571, STOCK6S-47743, CHEBI:45783, CID5291, DB00619, DB03261

Molecular Formula:	C₂₉H₃₁N₇O	Molecular Weight:	493.602740 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: KTUFNOKKBVMGRW-UHFFFAOYSA-N

• Imatinib Mesylate

IUPAC Name: methanesulfonic acid; 4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide | CAS Registry Number: 220127-57-1
Synonyms: Imatinib mesylate, Gleevec, Glivec, Imatinib mesilate, Gleevac, Gleevec (TN), Glivec (TN), Imatinib Methansulfonate, imatinib methanesulfonate, Imatinib mesilate (JAN), sti-571, HSDB 7142, MLS001401456, STI571, CHEBI:31690, STI 571, CGP 57148B, GGP-57148B, CGP 53715, CGP-57148

Molecular Formula:	C₃₀H₃₅N₇O₄S	Molecular Weight:	589.708400 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	10

InChIKey: YLMAHDNUQAMNNX-UHFFFAOYSA-N

• Imipenem

IUPAC Name: (5R,6S)-3-[2-(aminomethylideneamino)ethylsulfanyl]-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid | CAS Registry Number: 64221-86-9
Synonyms: imipenem, Imipemide, Tienamycin, Primaxin, Imipenem anhydrous, Imipenem (INN), Prestwick_844, N-Formimidoylthienamycin, Ambap1005, Prestwick0_000519, Prestwick1_000519, Prestwick2_000519, Prestwick3_000519, BSPBio_000477, SPBio_002398, BPBio1_000525, Imipenem, N-Formimidoyl thienamycin, AIDS007648, AIDS-007648, NSC717864

Molecular Formula:	C₁₂H₁₇N₃O₄S	Molecular Weight:	299.346080 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: ZSKVGTPCRGIANV-ZXFLCMHBSA-N

• INCB28060

IUPAC Name: 2-fluoro-N-methyl-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzamide | CAS Registry Number: 1029712-80-8
Synonyms: 2-fluoro-N-methyl-4-(7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl)benzamide, UNII-TY34L4F9OZ, SureCN1426819, cc-219, INC-280, INCB 28060, BCP9000785, QC-7530, RL00142, NCGC00346702-01, KB-137150, Y0337, 2-Fluoro-N-methyl-4-[7-[(quinolin-6-yl)methyl]imidazo[1,2-b]-[1,2,4]triazin-2-yl]benzamide

Molecular Formula:	C₂₃H₁₇FN₆O	Molecular Weight:	412.419083 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	6

InChIKey: LIOLIMKSCNQPLV-UHFFFAOYSA-N

• INK-128

IUPAC Name: 5-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-1,3-benzoxazol-2-amine | CAS Registry Number: 1224844-38-5
Synonyms: INK 128, SureCN7902875, INK128, INK-128/INK128, BCP9000789, CS-0557, NCGC00346654-01, HY-13328, BCP0726000086, INK-128,CAS:1224844-38-5, INK-128|1224844-38-5|INK128

Molecular Formula:	C₁₅H₁₅N₇O	Molecular Weight:	309.325900 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: GYLDXIAOMVERTK-UHFFFAOYSA-N

• IOX2

IUPAC Name: 2-[(1-benzyl-4-hydroxy-2-oxoquinoline-3-carbonyl)amino]acetic acid | CAS Registry Number: 931398-72-0
Synonyms: SureCN8244419, IOX 2, IOX-2, cc-642, QCR-246, CS-0988, RL05859, NCGC00344625-02, HY-15468, KB-146012, IOX2|931398-72-0|IOX-2, 2-(1-benzyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamido)acetic acid, N-[(1-BENZYL-4-HYDROXY-2-OXO-1,2-DIHYDRO-3-QUINOLINYL)CARBONYL]GLYCIN

Molecular Formula:	C₁₉H₁₆N₂O₅	Molecular Weight:	352.340740 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: CAOSCCRYLYQBES-UHFFFAOYSA-N

• IPI145

IUPAC Name: 8-chloro-2-phenyl-3-[(1S)-1-(7H-purin-6-ylamino)ethyl]isoquinolin-1-one | CAS Registry Number: 1201438-56-3
Synonyms: Duvelisib, IPI-145, Duvelisib [USAN], SureCN153543, UNII-610V23S0JI, CHEMBL3039502, INK-1197, IPI-145 (INK1197), CS-0888, HY-17044, QC-10232, IPI-145|1201438-56-3|IPI145, S7028,INK1197,1201438-56-3, (S)-3-(1-(7H-purin-6-ylamino)ethyl)-8-chloro-2-phenylisoquinolin-1(2H)-one, 1(2H)-Isoquinolinone, 8-chloro-2-phenyl-3-((1S)-1-(9H-purin-6-ylamino)ethyl)-, 8-Chloro-2-phenyl-3-((1S)-1-(7H-purin-6-ylamino)ethyl)isoquinolin-1(2H)-one

Molecular Formula:	C₂₂H₁₇ClN₆O	Molecular Weight:	416.862980 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: SJVQHLPISAIATJ-ZDUSSCGKSA-N

• Irinotecan HCl

Synonyms: Camptosar, Campto, Campto (TN), Irinotecan hydrochloride, CPT 11, CPT-11, Irinotecan hydrochloride hydrate, Irinotecan hydrochloride (USAN), Irinotecan hydrochloride [USAN:JAN], C35H41N3O5.3H2O.HCl, Irinotecan hydrochloride hydrate (JAN), IRINOTECAN HYDROCHLORIDE Trihydrate, LS-44590, D01061, (+)-7-Ethyl-10-hydroxycamptothecine 10-(1,4'-bipiperidine)-1'-carboxylate, monohydrochloride, trihydrate, (1,4'-Bipiperidine)-1'-carboxylic acid, 4,11-diethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-1H-pyrano(3',4':6,7)indolizino(1,2-b)quinolin-9-yl ester, monohydrochloride, trihydrate, (S)-, (1,4'-Bipiperidine)-1'-carboxylic acid, 4,11-diethyl-3,4,12,14-tetrahydro-4-hydroxy-3,14-dioxo-1H-pyrano(3',4':6,7)indolizino(1,2-b)quinolin-9-yl ester, monohydrochloride,trihydrate, (S)-

Molecular Formula:	C₃₃H₄₅ClN₄O₉	Molecular Weight:	677.184800 [g/mol]
H-Bond Donor:	5	H-Bond Acceptor:	11

InChIKey: KLEAIHJJLUAXIQ-JDRGBKBRSA-N

• ISOQUINOLINE-5-SULFONIC ACID (CAS: 27655-40-6)

• Ispinesib

IUPAC Name: N-(3-aminopropyl)-N-[(1R)-1-(3-benzyl-7-chloro-4-oxoquinazolin-2-yl)-2-methylpropyl]-4-methylbenzamide | CAS Registry Number: 336113-53-2
Synonyms: UNII-BKT5F9C2NI, nchembio.2007.34-comp1, CHEBI:485659, CID6851740, SB-715992, (R)-N-(3-aminopropyl)-N-(1-(3-benzyl-7-chloro-4-oxo-3,4-dihydroquinazolin-2-yl)-2-methylpropyl)-4-methylbenzamide, Benzamide, N-(3-aminopropyl)-N-((1R)-1-(7-chloro-3,4-dihydro-4-oxo-3-(phenylmethyl)-2-quinazolinyl)-2-methylpropyl)-4-methyl-

Molecular Formula:	C₃₀H₃₃ClN₄O₂	Molecular Weight:	517.061620 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: QJZRFPJCWMNVAV-HHHXNRCGSA-N

• Ixabepilone

IUPAC Name: (1R,5S,6S,7R,10S,14S,16S)-6,10-dihydroxy-1,5,7,9,9-pentamethyl-14-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-17-oxa-13-azabicyclo[14.1.0]heptadecane-8,12-dione | CAS Registry Number: 219989-84-1
Synonyms: Ixempra, Azaepothilone B, Ixempra kit, Ixabepilone [INN], 16-Aza-epothilone B, UNII-K27005NP0A, Ixabepilone (JAN/USAN/INN), BMS 247550-1, BMS-247550, CID6445540, NSC-710428, LS-98543, BMS 247550-01, D04645, 17-oxa-4-azabicyclo(14.1.0)heptadecane-5,9-dione, 7,11-dihydroxy-8,8,10,12,16-pentamethyl-3-((1E)-1-methyl-2-(2-methyl-4-thiazolyl)ethenyl)-, (1S,3S,7S,10R,11S,12S,16R)-, 1S,3S,7S,10R,11S,12S,16R)-7,11-Dihydroxy-8,8,10,12,16-pentamethyl-3-((1E)-1-methyl-2-(2-methylthiazol-4-yl)ethenyl)-17-oxa-4-azabicyclo(14.1.0)heptadecane-5,9-dione

Molecular Formula:	C₂₇H₄₂N₂O₅S	Molecular Weight:	506.697780 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	6

InChIKey: FABUFPQFXZVHFB-PVYNADRNSA-N

• JAK2 Inhibitor V Z3

IUPAC Name: 2-methyl-1-phenyl-4-pyridin-2-yl-2-(2-pyridin-2-ylethyl)butan-1-one | CAS Registry Number: 195371-52-9
Synonyms: MLS002608474, 2-methyl-1-phenyl-4-(pyridin-2-yl)-2-[2-(pyridin-2-yl)ethyl]butan-1-one, NSC42834, JAK2 Inhibitor V, Z3, AC1Q1R1I, SureCN2452835, AC1L613H, CHEMBL563485, CTK7F4205, HMS3092H09, NSC 42834, NSC-42834, AG-K-30139, AG-L-65856, CS-1006, HY-15480, SMR001527222, 1-Butanone, 2-methyl-1-phenyl-4-(2-pyridinyl)-2-[2-(2-pyridinyl)ethyl]-, 2-methyl-1-phenyl-4-pyridin-2-yl-2-(2-pyridin-2-ylethyl)butan-1-one, JAK2 Inhibitor V, Z3|195371-52-9|NSC 42834|1-Butanone, 2-methyl-1-phenyl-4-(2-pyridinyl)-2-[2-(2-pyridinyl)ethyl]-

Molecular Formula:	C₂₃H₂₄N₂O	Molecular Weight:	344.449460 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: SETYDCSRABYHSW-UHFFFAOYSA-N

• JTC 801; N-(4-AMINO-2-METHYL-6-QUINOLINYL)-2-[(4-ETHYLPHENOXY)METHYL]BENZAMIDE HCL

IUPAC Name: N-(4-amino-2-methylquinolin-6-yl)-2-[(4-ethylphenoxy)methyl]benzamide;hydrochloride | CAS Registry Number: 244218-51-7
Synonyms: JTC-801, JTC 801, JTC801, TCMDC-125882, N-(4-amino-2-methylquinolin-6-yl)-2-((4-ethylphenoxy)methyl)benzamide hydrochloride, N-(4-amino-2-methylquinolin-6-yl)-2-[(4-ethylphenoxy)methyl]benzamide hydrochloride, AC1NSKGE, N-(4-amino-2-methylquinolin-6-yl)-2-(4-ethylphenoxymethyl)benzamide hydrochloride, UNII-7I21WLZ2FP, SureCN2240337, ATL-146e, cc-187, Auryntricarboxylic acid (ATA), CHEMBL531742, CTK8E7568, ABP000782, DCL000287, DNC000263, DNC000828, CS-0561

Molecular Formula:	C₂₆H₂₆ClN₃O₂	Molecular Weight:	447.956540 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: NQLIYKXNAXKMBL-UHFFFAOYSA-N

• KN-62; 4-[(2S)-2-[(5-ISOQUINOLINYLSULFONYL)METHYLAMINO]-3-OXO-3 -(4-PHENYL-(PIPERAZIN-1-YL))PROPYL] PHENYL ISOQUINOLINESULFONIC ACID ESTER

IUPAC Name: [4-[2-[isoquinolin-5-ylsulfonyl(methyl)amino]-3-oxo-3-(4-phenylpiperazin-1-yl)propyl]phenyl] isoquinoline-5-sulfonate | CAS Registry Number: 127191-97-3
Synonyms: BiomolKI_000040, BiomolKI2_000048, KN62, KN-62, BSPBio_001181, KBioGR_000521, KBioSS_000521, KN 62, KBio2_000521, KBio2_003089, KBio2_005657, KBio3_000941, KBio3_000942, CID3838, C38H35N5O6S2, CHEBI:316155, MolPort-003-848-337, Bio2_000421, Bio2_000901, HMS1990K03

Molecular Formula:	C₃₈H₃₅N₅O₆S₂	Molecular Weight:	721.844400 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	10

InChIKey: RJVLFQBBRSMWHX-UHFFFAOYSA-N

• Ku-55933 (CAS: 587871-28-9)

• KU0063794

IUPAC Name: [5-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylpyrido[2,3-d]pyrimidin-7-yl]-2-methoxyphenyl]methanol | CAS Registry Number: 938440-64-3
Synonyms: Ku-0063794, KU-63794, KU 0063794, KU0063794, 938440-64-3, KU0063794, KU-0063794, S1226_Selleck, PubChem22475, cc-34, SureCN290211, UNII-81HJG228AB, CHEMBL1078983, CHEBI:716942, MolPort-018-493-667, ACT06824, ABP000901, RS0068, AKOS005145564, BCP9000821, CS-0065, EX-5106

Molecular Formula:	C₂₅H₃₁N₅O₄	Molecular Weight:	465.544740 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	9

InChIKey: RFSMUFRPPYDYRD-CALCHBBNSA-N

• KU14R; 2-(2-ETHYL-2,3-DIHYDRO-2-BENZOFURANYL)-1H-IMIDAZOLE

IUPAC Name: 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole | CAS Registry Number: 189224-48-4
Synonyms: KU14R, 2-(2-ETHYL-2,3-DIHYDRO-2-BENZOFURANYL)-1H-IMIDAZOLE, AC1N7ICL, SureCN12648485, KU 14R, CTK8E7553, MolPort-003-983-835, HMS3267M22, CS-1007, HY-15481, LS-78702, KB-220978, 2-(2-ethyl-3H-1-benzofuran-2-yl)-1H-imidazole, KU14R|189224-48-4|KU 14R, BRD-A38747044-001-01-5, 2-(2-ethyl-2,3-dihydrobenzofuran-2-yl)-1H-imidazole

Molecular Formula:	C₁₃H₁₄N₂O	Molecular Weight:	214.263060 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: JCWVNNMJXQJVNC-UHFFFAOYSA-N

• KW-2478

IUPAC Name: 2-[2-ethyl-3,5-dihydroxy-6-[3-methoxy-4-(2-morpholin-4-ylethoxy)benzoyl]phenyl]-N,N-bis(2-methoxyethyl)acetamide | CAS Registry Number: 819812-04-9
Synonyms: 819812-04-9 pound not KW2478 pound not KW 2478, UNII-QY50S617NM, cc-326, BCPP000191, BCP9000825, KW 2478, QC-7253, RL05131, NCGC00346685-01, BCP0726000279, KB-145989, 2-(2-ethyl-3,5-dihydroxy-6-(3-methoxy-4-(2-morpholinoethoxy)benzoyl)phenyl)-N,N-bis(2-methoxyethyl)acetamide, 2-(2-ethyl-3,5-dihydroxy-6-{3-methoxy-4-[2-(morpholin-4-yl)ethoxy]benzoyl}phenyl)-N,N-bis(2-methoxyethyl)acetamide, 2-ethyl-3,5-dihydroxy-n,n-bis(2-methoxyethyl)-6-(3-methoxy-4-(2-(4-morpholinyl)ethoxy)benzoyl)benzeneacetamide

Molecular Formula:	C₃₀H₄₂N₂O₉	Molecular Weight:	574.662480 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	10

InChIKey: VFUXSYAXEKYYMB-UHFFFAOYSA-N

• KY02111

IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)propanamide | CAS Registry Number: 1118807-13-8
Synonyms: T6355696, ZINC07485953, AC1P97UT, AKOS007976129, AM81229, MCULE-4275070249, QC-8207, NCGC00347949-01, Benzenepropanamide, N-(6-chloro-2-benzothiazolyl)-3,4-dimethoxy-, S7096,KY 02111,1118807-13-8, N-(6-chloro-1,3-benzothiazol-2-yl)-3-(3,4-dimethoxyphenyl)propanamide, N-(6-chlorobenzo[d]thiazol-2-yl)-3-(3,4-dimethoxyphenyl)propanamide

Molecular Formula:	C₁₈H₁₇ClN₂O₃S	Molecular Weight:	376.857180 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: LXFKEVQQSKQXPR-UHFFFAOYSA-N

• L-3-Trans-Hydroxyproline

IUPAC Name: (2S,3S)-3-hydroxypyrrolidin-1-ium-2-carboxylate | CAS Registry Number: 4298-08-2
Synonyms: trans-L-3-Hydroxyproline, CPD-664, ZINC04096639, CID11877126

Molecular Formula:	C₅H₉NO₃	Molecular Weight:	131.129860 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: BJBUEDPLEOHJGE-IMJSIDKUSA-N

• L-694,247; 2-[5-[3-(4-METHYLSULFONYLAMINO)BENZYL-1,2,4-OXADIAZOL-5- YL]-1H-INDOL-3-YL]ETHANAMINE

IUPAC Name: N-[4-[[5-[3-(2-aminoethyl)-1H-indol-5-yl]-1,2,4-oxadiazol-3-yl]methyl]phenyl]methanesulfonamide | CAS Registry Number: 137403-12-4
Synonyms: Tocris-0781, Biomol-NT_000112, BPBio1_000001, CHEBI:156779, CID132059, MolPort-003-943-292, PDSP1_001394, PDSP2_001378, NCGC00024787-01, NCGC00024787-02, L 694247, L-694,247, L-694247, C085632, L000336, L694247, BRD-K18816859-001-01-4, 2-(5-(3-(4-(Methylsulfonylamino)benzyl)-1,2,4-oxadiazol-5-yl)-1H-indole-3-yl)ethylamine, Methanesulfonamide, N-(4-((5-(3-(2-aminoethyl)-1H-indol-5-yl)-1,2,4-oxadiazol-3-yl)methyl)phenyl)-, N-(4-{5-[3-(2-Amino-ethyl)-1H-indol-5-yl]-[1,2,4]oxadiazol-3-ylmethyl}-phenyl)-methanesulfonamide

Molecular Formula:	C₂₀H₂₁N₅O₃S	Molecular Weight:	411.477440 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	7

InChIKey: HKXMQLISPYELRD-UHFFFAOYSA-N

• L-Alanine 4-nitroanilide hydrochloride

IUPAC Name: 2-amino-N-(4-nitrophenyl)propanamide hydrochloride | CAS Registry Number: 31796-55-1
Synonyms: EINECS 250-811-0, (S)-2-Amino-N-(4-nitrophenyl)propionamide hydrochloride

Molecular Formula:	C₉H₁₂ClN₃O₃	Molecular Weight:	245.662880 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	4

InChIKey: YEXRLSXNWLNHQR-UHFFFAOYSA-N

• L-Alanine-7-amido-4-methylcoumarin trifluoroacetate salt

IUPAC Name: [(2S)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopropan-2-yl]azanium | CAS Registry Number: 96594-10-4
Synonyms: ZINC00057544, CID6921823

Molecular Formula:	C₁₃H₁₅N₂O₃+	Molecular Weight:	247.269800 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: IWSOXHMIRLSLKT-QMMMGPOBSA-O

• L-Isoleucine 4-Nitroanilide,

IUPAC Name: (2R,3R)-2-amino-3-methyl-N-(4-nitrophenyl)pentanamide | CAS Registry Number: 70324-66-2
Synonyms: L-Isoleucine 4-nitroanilide, CTK8G0594, AG-G-74625

Molecular Formula:	C₁₂H₁₇N₃O₃	Molecular Weight:	251.281680 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: NCCAUSZFESISCS-LDYMZIIASA-N

• L-Leucine-7-amino-4-methylcoumarin hydrochloride

IUPAC Name: [(2S)-4-methyl-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]azanium | CAS Registry Number: 62480-44-8
Synonyms: ZINC00056783, CID6921634

Molecular Formula:	C₁₆H₂₁N₂O₃+	Molecular Weight:	289.349540 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: GTAAIHRZANUVJS-ZDUSSCGKSA-O

• L-Methionine 4-Methyl-7-Coumarinylamide Trifluoroacetate

IUPAC Name: (2S)-2-amino-N-(4-methyl-2-oxochromen-7-yl)-4-methylsulfanylbutanamide;2,2,2-trifluoroacetic acid | CAS Registry Number: 94367-35-8
Synonyms: ST057512, L-Methionine 7-amido-4-methylcoumarin trifluoroacetate salt, AC1MBZPO, 64367_FLUKA, 64367_SIGMA, CTK8G0621, AG-H-89673, L-Methionine 7-amido-4-methylcoumarin, trifluoroacetate salt, (2S)-2-amino-N-(4-methyl-2-oxochromen-7-yl)-4-methylsulfanylbutanamide; 2,2,2-trifluoroacetic acid, (2S)-2-amino-N-(4-methyl-2-oxochromen-7-yl)-4-methylthiobutanamide, 2,2,2-trif luoroacetic acid

Molecular Formula:	C₁₇H₁₉F₃N₂O₅S	Molecular Weight:	420.403370 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	10

InChIKey: VSAUWUJWXBUSEU-YDALLXLXSA-N

• L-PROLINE P-NITROANILIDE TRIFLUOROACETIC ACID

IUPAC Name: N-(4-nitrophenyl)pyrrolidine-2-carboxamide | CAS Registry Number: 108321-19-3
Synonyms: L-proline-p-nitroanilide, L-PROLINE p-NITROANILIDE, CPD-11635, CID4147666, N-(4-nitrophenyl)pyrrolidine-2-carboxamide

Molecular Formula:	C₁₁H₁₃N₃O₃	Molecular Weight:	235.239220 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: JWXPYNYNEUYKOW-UHFFFAOYSA-N

• Laquinimod

IUPAC Name: 5-chloro-N-ethyl-2-hydroxy-1-methyl-4-oxo-N-phenylquinoline-3-carboxamide | CAS Registry Number: 248281-84-7
Synonyms: UNII-908SY76S4G, CHEBI:202755, ABR 215062, CID216469, ABR-215062, C476223, 3-Quinolinecarboxamide, 5-chloro-N-ethyl-1,2-dihydro-4-hydroxy-1-methyl-2-oxo-N-phenyl-, N-Ethyl-N-phenyl-1,2-dihydro-4-hydroxy-5-chloro-1-methyl-2-oxoquinoline-3-carboxamide, N-Ethyl-N-phenyl-5-chloro-1,2-dihydro-4-hydroxy-1-methyl-2-oxoquinoline-3-carboxamide, 5-Chloro-4-hydroxy-1-methyl-2-oxo-1,2-dihydro-quinoline-3-carboxylic acid ethyl-phenyl-amide

Molecular Formula:	C₁₉H₁₇ClN₂O₃	Molecular Weight:	356.802880 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: PVTNCGYZIYKPJX-UHFFFAOYSA-N

• LDN-211904

IUPAC Name: N-(2-chlorophenyl)-6-piperidin-4-ylimidazo[1,2-a]pyridine-3-carboxamide;oxalic acid

Molecular Formula:	C₂₁H₂₁ClN₄O₅	Molecular Weight:	444.872 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	7

InChIKey: ODBJGLKPAQMCJA-UHFFFAOYSA-N