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Jinan Trio PharmaTech Co., Ltd.

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Profile: Jinan Trio PharmaTech Co., Ltd. specializes in APIs & intermediates, heterocyclic compounds, and anti-tumor drugs. Our products include crizotinib, vemurafenib, afatinib, vandetanib, regorafenib, brivanib alaninate, pyridazine, imidazole, pyrazole, and oxazole. We are specialized in providing over 1000 products including molecular targeted anticancer drugs, cell signaling pathway inhibitors, pharmaceutical intermediates, and heterocyclic compounds, and quality services including custom synthesis, transfer of new drug patent and technology, technical cooperation, and process optimization.

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• GW 5074; 3-(3,5-DIBROMO-4-HYDROXY-BENZYLIDENE)-5-IODO-1,3-DIHYDRO -INDOL-2-ONE
IUPAC Name: (3Z)-3-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-5-iodo-1H-indol-2-one | CAS Registry Number: 220904-83-6
Synonyms: gw5074, GW 5074, Raf1 Kinase Inhibitor I, InSolution™ Raf1 Kinase Inhibitor I, 5-Iodo-3-[(3,5-dibromo-4-hydroxyphenyl)methylene]-2-indolinone, STO521, 3-(3,5-Dibromo-4-hydroxybenzyliden)-5-iodo-1,3-dihydroindol-2-one, Tocris-1381, BiomolKI_000056, Lopac-G-6416, BiomolKI2_000062, SureCN149921, AC1O00KW, Lopac0_000510, BMK1-F8, BSPBio_001275, cc-462, CHEMBL72365, G6416_SIGMA, BCBcMAP01_000125

Molecular Formula: C15H8Br2INO2Molecular Weight: 520.941990 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LMXYVLFTZRPNRV-KMKOMSMNSA-N

• 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: C25H23N5O2Molecular Weight: 425.482420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: SAGZIBJAQGBRQA-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: C20H22N4O3Molecular Weight: 366.413680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: MYQAUKPBNJWPIE-UHFFFAOYSA-N

• HMN-214
IUPAC Name: N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-(1-oxidopyridin-1-ium-4-yl)ethenyl]phenyl]acetamide | CAS Registry Number: 173529-46-9
Synonyms: HMN 214, IVX-214, (E)-4-(2-(2-(N-Acetyl-N-((p-methoxyphenyl)sulfonyl)amino)phenyl)ethenyl)pyridine 1-oxide, Acetamide, N-((4-methoxyphenyl)sulfonyl)-N-(2-((1E)-2-(1-oxido-4-pyridinyl)ethenyl)phenyl)-, Acetamide, N-((4-methoxyphenyl)sulfonyl)-N-(2-(2-(1-oxido-4-pyridinyl)ethenyl)phenyl)-, (E)-, CID9888590, cc-31, SureCN5173713, HMN214, BCPP000212, DCL000128, BCP9000762, N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-(1-oxidopyridin-4-yl)ethenyl]phenyl]acetamide, X7375, A811525, (E)-4-(2-(2-(N-Acetyl-N-(4-methoxybenzenesulfonyl)amino)stilbazole)) 1-oxide, Acetamide, N-[(4-methoxyphenyl)sulfonyl]-N-[2-[(1E)-2-(1-oxido-4-pyridinyl)ethenyl]phenyl], N-(4-methoxybenzenesulfonyl)-N-{2-[(E)-2-(1-oxo-1$l^{5}-pyridin-4-yl)ethenyl]phenyl}acetamide, N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-(1-oxidanidylpyridin-1-ium-4-yl)ethenyl]phenyl]ethanamide, N-(4-methoxyphenyl)sulfonyl-N-[2-[(E)-2-(1-oxido-4-pyridin-1-iumyl)ethenyl]phenyl]acetamide

Molecular Formula: C22H20N2O5SMolecular Weight: 424.469600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: OCKHRKSTDPOHEN-BQYQJAHWSA-N

• Homovanillic Acid
IUPAC Name: 2-(4-hydroxy-3-methoxyphenyl)acetic acid | CAS Registry Number: 306-08-1
Synonyms: Homovanillic acid, Homovanillate, Vanillacetic acid, HMPA, Lopac-H-1252, 4-Hydroxy-3-methoxyphenylacetic acid, Lopac0_000632, Oprea1_505423, MLS001056771, H1252_SIGMA, 3-Methoxy-4-hydroxyphenylacetate, Benzeneacetic acid, 4-hydroxy-3-methoxy-, 3-Methoxy-4-hydroxyphenylacetic acid, 4-Hydroxy-3-methoxybenzeneacetic acid, NSC16682, EINECS 206-176-7, Acetic acid, (4-hydroxy-3-methoxyphenyl)-, NSC 16682, NCGC00015497-01, NCGC00093999-01

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QRMZSPFSDQBLIX-UHFFFAOYSA-N

• Honokiol
IUPAC Name: 2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol | CAS Registry Number: 35354-74-6
Synonyms: nchembio.140-comp3, MLS000759481, MLS001048916, MLS001423980, H4914_SIGMA, 3,5'-Diallyl-4,2'-dihydroxybiphenyl, AIDS002243, BB_NC-1461, 3',5-Diallylbiphenyl-2,4'-diol, NSC 293100, AIDS-002243, C18H18O2, CID72303, NSC293100, ZINC00001536, 5,3'-Diallyl-2,4'-dihydroxybiphenyl, SMP2_000040, NCGC00163567-01, NCGC00163567-02, CPD000387107

Molecular Formula: C18H18O2Molecular Weight: 266.334320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FVYXIJYOAGAUQK-UHFFFAOYSA-N

• Icotinib
Synonyms: CHEMBL2087361, Conmana, icotinib,BPI-2009H, UNII-9G6U5L461Q, BPI-2009, (1,4,7,10)Tetraoxacyclododecino(2,3-g)quinazolin-4-amine, N-(3-ethynylphenyl)-7,8,10,11,13,14-hexahydro-

Molecular Formula: C22H21N3O4Molecular Weight: 391.419840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: QQLKULDARVNMAL-UHFFFAOYSA-N

• Ilomastat
IUPAC Name: (2R)-N'-hydroxy-N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]-2-(2-methylpropyl)butanediamide | CAS Registry Number: 142880-36-2
Synonyms: Galardin, Galardin MPI, Ilomastat [USAN], Ilomastat (USAN/INN), GM 6001, CBiol_001883, BSPBio_001079, KBioGR_000419, KBioSS_000419, BCBcMAP01_000057, KBio2_000419, KBio2_002987, KBio2_005555, KBio3_000797, KBio3_000798, CS 610, Bio1_000169, Bio1_000658, Bio1_001147, Bio2_000370

Molecular Formula: C20H28N4O4Molecular Weight: 388.460720 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 4

InChIKey: NITYDPDXAAFEIT-DYVFJYSZSA-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: C29H31N7OMolecular Weight: 493.602740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: KTUFNOKKBVMGRW-UHFFFAOYSA-N

• IMD 0354; N-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]-5-CHLORO-2-HYDROXYBEN ZAMIDE
IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-5-chloro-2-hydroxybenzamide | CAS Registry Number: 978-62-1
Synonyms: IMD-0354, IKK-2 Inhibitor V, IMD 0354, CHEMBL536151, N-(3,5-Bis-trifluoromethylphenyl)-5-chloro-2-hydroxybenzamide, TCMDC-125465, N-(3,5-bis(trifluoromethyl)phenyl)-5-chloro-2-hydroxybenzamide, N-[3,5-bis(trifluoromethyl)phenyl]-5-chloro-2-hydroxybenzamide, IMD0354, Kinome_1864, AC1NO40S, I3159_SIGMA, CTK8G0277, HMS3229F11, HMS3269F13, UNII-76145IS906, IN1463, AG-H-98244, BCP9000777, NCGC00165811-01

Molecular Formula: C15H8ClF6NO2Molecular Weight: 383.672939 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: CHILCFMQWMQVAL-UHFFFAOYSA-N

• Imidazo[1,2-a]pyridin-2(3H)-one hydrochloride
IUPAC Name: 3H-imidazo[1,2-a]pyridin-2-one;hydrochloride | CAS Registry Number: 52687-85-1
Synonyms: imidazo(1,2-a)pyridin-2(3h)-one hydrochloride, PubChem23703, SureCN3306488, CTK8B8592, MolPort-003-912-125, ACN-P000818, ANW-60773, AKOS015831807, RL03941, AK-80162, KB-52554, 3H-imidazo[1,2-a]pyridin-2-one hydrochloride, A829204, I14-15855

Molecular Formula: C7H7ClN2OMolecular Weight: 170.596280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YLYILEUMTDOZTJ-UHFFFAOYSA-N

• Imidazo[1,2-A]Pyridin-8-Ylamine
IUPAC Name: imidazo[1,2-a]pyridin-8-amine | CAS Registry Number: 73221-18-8
Synonyms: IMIDAZO[1,2-A]PYRIDIN-8-YLAMINE, Imidazo[1,2-a]pyridin-8-amine, H-imidazo[1,2-a]pyridin-8-amine, SBB052098, PubChem22323, SureCN335977, AGN-PC-00P64E, CTK2H5980, MolPort-008-155-908, Imidazo[1,2-a]pyridin-8-ylamine;, ANW-50456, WTI-10074, ZINC34551954, AKOS006292620, AG-C-11755, AG-G-89253, MCULE-6007212180, PB32476, RP20069, 8-AMINOIMIDAZO[1,2-A]PYRIDINE

Molecular Formula: C7H7N3Molecular Weight: 133.150580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LKQXJYDAALZCAF-UHFFFAOYSA-N

• Imidazo[1,2-a]pyrido[4,3-d]pyrimidin-5(3H)-one,2,6,7,8,9,10-hexahydro-10-[(2-methylphenyl)methyl]-7-(phenylmethyl)-
Synonyms: NSC350625, MLS003171082, NSC-350625, AC1L7JLY, NCIStruc1_001799, NCIStruc2_001940, SureCN13559495, CCG-37418, NCGC00014802, NCI350625, NCGC00014802-02, NCGC00097903-01, NCI60_003126, SMR001874991, 7-benzyl-10-(2-methylbenzyl)-2,6,7,8,9,10-hexahydroimidazo[1,2-a]pyrido[4,3-d]pyrimidin-5(3H)-one

Molecular Formula: C24H26N4OMolecular Weight: 386.489440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: RSAQARAFWMUYLL-UHFFFAOYSA-N

• Imidazo[2,1-b]thiazole-5-carboxylic acid
IUPAC Name: imidazo[2,1-b][1,3]thiazole-5-carboxylic acid | CAS Registry Number: 17782-81-9
Synonyms: imidazo[2,1-b][1,3]thiazole-5-carboxylic acid, SureCN269609, MolPort-008-626-706, ANW-49066, RW4012, AKOS015920176, RP23087, 5-imidazo[2,1-b]thiazolecarboxylic acid, AK-31309, BR-31309, KB-77866, W3878, A812301

Molecular Formula: C6H4N2O2SMolecular Weight: 168.173160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZGIABSKPSCMXFD-UHFFFAOYSA-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: C23H17FN6OMolecular Weight: 412.419083 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: LIOLIMKSCNQPLV-UHFFFAOYSA-N

• Indole-3-acetamide
IUPAC Name: 2-(1H-indol-3-yl)acetamide | CAS Registry Number: 879-37-8
Synonyms: Indoleacetamide, indole-3-acetamide, 1H-Indole-3-acetamide, 3-Indoleacetamide, 3-Indolylacetamide, (indol-3-yl)acetamide, 2-(3-Indolyl)acetamide, 2-(1H-Indol-3-yl)acetamide, Indole-3-acetamide (8CI), Oprea1_704903, 286281_ALDRICH, CID397, NSC 1969, CHEBI:16031, CPD-237, Indole-3-acetamide (6CI,8CI), NSC1969, AIDS019635, AIDS-019635, EINECS 212-904-4

Molecular Formula: C10H10N2OMolecular Weight: 174.199200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ZOAMBXDOGPRZLP-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: C15H15N7OMolecular Weight: 309.325900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: GYLDXIAOMVERTK-UHFFFAOYSA-N

• Insulin-like Growth Factor-1 Receptor Inhibitor
IUPAC Name: (3E)-4-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]-3-(4-methyl-6-morpholin-4-yl-1,3-dihydrobenzimidazol-2-ylidene)pyridin-2-one | CAS Registry Number: 468740-43-4
Synonyms: BCPP000328, BCP9000426

Molecular Formula: C25H26ClN5O3Molecular Weight: 479.958640 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: UGQMURPIMYALPH-ZNTNEXAZSA-N

• Intedanib
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: 656247-17-5
Synonyms: Vargatef, BIBF-1120, BIBF1120, 928326-83-4, Nintedanib, BIBF 1120, Vargatef, BIBF1120, (Z)-methyl 3-((4-(N-methyl-2-(4-methylpiperazin-1-yl)acetamido)phenylamino)(phenyl)methylene)-2-oxoindoline-6-carboxylate, S1010_Selleck, BIBF1120,Vargatef, PubChem20543, Bibf1120 - Vargatef, Nintedanib (USAN/INN), Vargatef, BIBF 1120, cc-88, SureCN431006, CHEMBL502835, QCR-43, CHEBI:622730, RS0107

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

InChIKey: XZXHXSATPCNXJR-ZIADKAODSA-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: C19H16N2O5Molecular Weight: 352.340740 [g/mol]
H-Bond Donor: 3H-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: C22H17ClN6OMolecular Weight: 416.862980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: SJVQHLPISAIATJ-ZDUSSCGKSA-N

• Isothiazalone
IUPAC Name: 1,2-thiazol-3-one | CAS Registry Number: 1003-07-2
Synonyms: 3-Isothiazolone, Isothiazol-3-one, 3(2H)-Isothiazolone, NCIOpen2_001597, NSC93489, AIDS125977, AIDS-125977, NSC 93489, NCI60_042085, TL8000042

Molecular Formula: C3H3NOSMolecular Weight: 101.127020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MGIYRDNGCNKGJU-UHFFFAOYSA-N

• Isothiazolo[5,4-b]pyridin-3(2H)-one, 1,1-dioxide
IUPAC Name: 1,1-dioxo-[1,2]thiazolo[5,4-b]pyridin-3-one | CAS Registry Number: 138417-40-0
Synonyms: Isothiazolo[5,4-b]pyridin-3(2H)-one 1,1-dioxide, ACMC-20adbx, AGN-PC-003HJU, CTK0B8283, ANW-68203, AKOS016007145, AK-80617, KB-77966, Isothiazolo[5,4-b]pyridin-3(2H)-one,1,1-dioxide, 2H,3H-1$l^{6},2,7-[1$l^{6},2]thiazolo[5,4-b]pyridine-1,1,3-trione

Molecular Formula: C6H4N2O3SMolecular Weight: 184.172560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: TYWYQFLITLNVEM-UHFFFAOYSA-N

• Isothiazolo[5,4-c]pyridin-3(2H)-one, 1,1-dioxide
IUPAC Name: 1,1-dioxo-[1,2]thiazolo[5,4-c]pyridin-3-one | CAS Registry Number: 142141-07-9
Synonyms: Isothiazolo[5,4-c]pyridin-3(2H)-one 1,1-dioxide, AGN-PC-003Y8C, CTK8B9054, MolPort-000-884-699, ANW-61910, AKOS000282122, AK-80620, KB-77967, Isothiazolo[5,4-c]pyridin-3(2H)-one,1,1-dioxide

Molecular Formula: C6H4N2O3SMolecular Weight: 184.172560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OCDUJMWEISRJAC-UHFFFAOYSA-N

• Isoxazole, 4-Bromo-3-Ethoxy-5-Methyl- (9CI)
IUPAC Name: 4-bromo-3-ethoxy-5-methyl-1,2-oxazole | CAS Registry Number: 169310-98-9
Synonyms: 4-Bromo-3-ethoxy-5-methylisoxazole, 4-BROMO-3-ETHOXY-5-METHYL-ISOXAZOLE, PubChem24241, CTK8C2316, MolPort-004-789-027, ANW-68192, AKOS016007227, Isoxazole,4-bromo-3-ethoxy-5-methyl-, AK-80632, KB-77974

Molecular Formula: C6H8BrNO2Molecular Weight: 206.037220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WYGNIHJIFAZCBL-UHFFFAOYSA-N

• JNK-IN-8
IUPAC Name: 3-[[(E)-4-(dimethylamino)but-2-enoyl]amino]-N-[3-methyl-4-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide | CAS Registry Number: 1410880-22-6
Synonyms: CHEMBL2216824, CS-0601, HY-13319, JNK-IN-8|1410880-22-6, S4901,1410880-22-6

Molecular Formula: C29H29N7O2Molecular Weight: 507.586260 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: GJFCSAPFHAXMSF-UXBLZVDNSA-N

• KI 8751; N-(2,4-DIFLUOROPHENYL)-N'-[4-[(6,7-DIMETHOXY-4-QUINOLINY L)OXY]-2-FLUOROPHENYL]UREA
IUPAC Name: 1-(2,4-difluorophenyl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2-fluorophenyl]urea | CAS Registry Number: 228559-41-9
Synonyms: Ki8751, Ki 8751, Ki-8751, Ki8751, S1363_Selleck, AGN-PC-006NWD, SureCN1249562, cc-604, CHEMBL178455, CTK8E8844, CHEBI:399423, MolPort-021-804-894, HMS3269O17, Ki-8751, ABP001020, Ki8751-Supplied by Selleck Chemicals, BCP9000009, CS-0190, NCGC00167768-01, NCGC00167768-02, HY-12038

Molecular Formula: C24H18F3N3O4Molecular Weight: 469.412630 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: LFKQSJNCVRGFCC-UHFFFAOYSA-N

• KRN 633
IUPAC Name: 1-[2-chloro-4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-3-propylurea | CAS Registry Number: 286370-15-8
Synonyms: KRN-633, CHEMBL406381, KRN633, S1557_Selleck, K00589a, VEGF Receptor Tyrosine Kinase Inhibitor III, KRN633, KRN633, KRN-633, KRN 633, N-(2-Chloro-4-((6,7-dimethoxy-4-quinazolinyl)oxy)phenyl)-N′-propylurea, 1-(2-chloro-4-(6,7-dimethoxyquinazolin-4-yloxy)phenyl)-3-propylurea, CID9549295, SureCN1249684, cc-528, MolPort-016-633-236, DCL000355, FD7289, CS-0220, RL02972, KRN 633-Supplied by Selleck Chemicals, NCGC00346548-01, HY-12060

Molecular Formula: C20H21ClN4O4Molecular Weight: 416.858140 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: VPBYZLCHOKSGRX-UHFFFAOYSA-N

• KU-60019
IUPAC Name: 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[5-(6-morpholin-4-yl-4-oxopyran-2-yl)-9H-thioxanthen-2-yl]acetamide | CAS Registry Number: 925701-49-1
Synonyms: ku60019, KU 60019, S1570_Selleck, cc-509, MolPort-016-633-240, CS-0221, RL05828, NCGC00229735-01, NCGC00229735-02, NCGC00229735-03, HY-12061, KB-53044, KU-60019-Supplied by Selleck Chemicals, X7426, KU-60019|925701-49-1|KU 60019, KU60019,KU 60019,925701-49-1, pound molweight:547.66512) , KU60019 , KU 60019 , 925701-49-1, 2-((2S,6R)-2,6-dimethylmorpholino)-N-(5-(6-morpholino-4-oxo-4H-pyran-2-yl)-9H-thioxanthen-2-yl)acetamide, 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-{5-[6-(morpholin-4-yl)-4-oxopyran-2-yl]-9H-thioxanthen-2-yl}acetamide

Molecular Formula: C30H33N3O5SMolecular Weight: 547.665120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: SCELLOWTHJGVIC-BGYRXZFFSA-N

• 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: C25H31N5O4Molecular Weight: 465.544740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 9

InChIKey: RFSMUFRPPYDYRD-CALCHBBNSA-N

• KW-2449
IUPAC Name: [4-[(E)-2-(1H-indazol-3-yl)ethenyl]phenyl]-piperazin-1-ylmethanone | CAS Registry Number: 1000669-72-6
Synonyms: KW2449, KW 2449, CHEMBL1908397, 1000669-72-6 , KW 2449, KW-2449, KW 2449, KW2449, S2158_Selleck, SureCN1596894, cc-533, MolPort-016-633-288, BCP9000826, CS-0231, RL00013, KW 2449-Supplied by Selleck Chemicals, HY-10339, KB-78038, X7371, KW-2449|1000669-72-6|KW2449, [4-[2-(1H-Indazol-3-yl)ethenyl]phenyl]-1-piperazinylmethanone, 3-[(E)-2-[4-(piperazine-1-carbonyl)phenyl]ethenyl]-1H-indazole, (E)-(4-(2-(1H-indazol-3-yl)vinyl)phenyl)(piperazin-1-yl)methanone

Molecular Formula: C20H20N4OMolecular Weight: 332.399000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: YYLKKYCXAOBSRM-JXMROGBWSA-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: C30H42N2O9Molecular Weight: 574.662480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 10

InChIKey: VFUXSYAXEKYYMB-UHFFFAOYSA-N

• L-Serinamide, O-methyl-N-[(2-methyl-5-thiazolyl)carbonyl]-L-seryl-O-methyl-N-[(1S)-2-[(2R)-2-methyl-2-oxiranyl]-2-oxo-1-(phenylmethyl)ethyl]-
IUPAC Name: N-[(2S)-3-methoxy-1-[[(2S)-3-methoxy-1-[[(2S)-1-[(2R)-2-methyloxiran-2-yl]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]-2-methyl-1,3-thiazole-5-carboxamide | CAS Registry Number: 935888-69-0
Synonyms: Oprozomib, ONX-0912, Oprozomib [USAN], Oprozomib (USAN/INN), UNII-MZ37792Y8J, CHEMBL2103884, ONX 0912, PR-047, QC-9273, NCGC00345799-01, D10318, L-Serinamide, O-methyl-N-((2-methyl-5-thiazolyl)carbonyl)-L-seryl-O-methyl-N-((1S)-2- ((2R)-2-methyl-2-oxiranyl)-2-oxo-1-(phenylmethyl)ethyl)-, N-((S)-3-methoxy-1-((S)-3-methoxy-1-((S)-1-((R)-2-methyloxiran-2-yl)-1-oxo-3-phenylpropan-2-ylamino)-1-oxopropan-2-ylamino)-1-oxopropan-2-yl)-2-methylthiazole-5-carboxamide, O-Methyl-N-((2-methylthiazol-5-yl)carbonyl)-L-seryl-O-methyl-N-((1S)-1-benzyl-2-((2R)- 2-methyloxiran-2-yl)-2-oxoethyl)-L-serinamide

Molecular Formula: C25H32N4O7SMolecular Weight: 532.609180 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: SWZXEVABPLUDIO-WSZYKNRRSA-N

• L-THREONINAMIDE,N-ACETYL-N-METHYL-L-ISOLEUCYL-L-ISOLEUCYL-N-((1S)-3-METHYL-1-(((2R)-2-METHYLOXIRANYL)CARBONYL)BUTYL)-
IUPAC Name: (2S,3S)-2-[[(2S,3S)-2-[acetyl(methyl)amino]-3-methylpentanoyl]amino]-N-[(2S,3R)-3-hydroxy-2-[[4-methyl-1-[(2R)-2-methyloxiran-2-yl]-1-oxopentan-2-yl]amino]butanoyl]-3-methylpentanamide | CAS Registry Number: 134381-21-8
Synonyms: epoxomicin, CHEBI:447838, MolPort-006-822-455, CID3035402, CID 3035402, C078846, (2S,3S)-2-[(2S,3S)-2-(acetyl-methyl-amino)-3-methyl-pentanoylamino]-3-methyl-pentanoic acid {(2S,3R)-3-hydroxy-2-[3-methyl-1-((R)-2-methyl-oxiranecarbonyl)-butylamino]-butyryl}-amide, L-Threoninamide, N-acetyl-N-methyl-L-isoleucyl-L-isoleucyl-N-((1S)-3-methyl-1-(((2R)-2-methyloxiranyl)carbonyl)butyl)-, N-Acetyl-N-methyl-L-isoleucyl-L-isoleucyl-N-(3-methyl-1-((2-methyloxiranyl)carbonyl)butyl)-L-threoninamide

Molecular Formula: C28H50N4O7Molecular Weight: 554.719200 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: ZWCBKZGIPPDRLY-TXLQCSLMSA-N

• Lactacystin
IUPAC Name: (2R)-2-acetamido-3-[(3S,4R)-3-hydroxy-2-[(1S)-1-hydroxy-2-methylpropyl]-4-methyl-5-oxopyrrolidine-2-carbonyl]sulfanylpropanoic acid | CAS Registry Number: 133343-34-7
Synonyms: lactacystin, NChemBio.2007.16-comp4, C15H24N2O7S, CHEBI:606509, Bio1_000949, CID3034764, LS-172867, L-Cysteine, N-acetyl-, (2R,3S,4R)-3-hydroxy-2-(1-hydroxy-2-methylpropyl)-4-methyl-5-oxo-2-pyrrolidinecarboxylate (ester), L-Cysteine, N-acetyl-, 3-hydroxy-2-(1-hydroxy-2-methylpropyl)-4-methyl-5-oxo-2-pyrrolidinecarboxylate (ester), (2R-(2alpha,2(S*),3alpha,4alpha))-, (R)-2-acetamido-3-((3S,4R)-3-hydroxy-2-((S)-1-hydroxy-2-methylpropyl)-4-methyl-5-oxopyrrolidine-2-carbonylthio)propanoic acid

Molecular Formula: C15H24N2O7SMolecular Weight: 376.425260 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 7

InChIKey: DAQAKHDKYAWHCG-WVDSPMRNSA-N

• Lapatinib
IUPAC Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine | CAS Registry Number: 231277-92-2
Synonyms: Tykerb, Lapatinib [INN], 1xkk, Lapatinib Ditosylate, nchembio866-comp20, Lapatinib tosilate hydrate, GW572016, CHEBI:49603, GSK 572016, GW 572016, CID208908, DB01259, NCGC00167507-01, LS-187029, LS-187771, FMM, N-{3-CHLORO-4-[(3-FLUOROBENZYL)OXY]PHENYL}-6-[5-({[2-(METHYLSULFONYL)ETHYL]AMINO}METHYL)-2-FURYL]-4-QUINAZOLINAMINE, 4-Quinazolinamine, N-(3-chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-(((2-(methylsulfonyl)ethyl)amino)methyl)-2-furanyl)-, N-(3-chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-(((2-(methylsulfonyl)ethyl)amino)methyl)-2-furanyl)-4-quinazolinamine, N-(3-Chloro-4-((3-fluorophenyl)methoxy)phenyl)-6-(5-((2-methylsulfonylethylamino)methyl)-2-furyl)quinazolin-4-amine

Molecular Formula: C29H26ClFN4O4SMolecular Weight: 581.057543 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 9

InChIKey: BCFGMOOMADDAQU-UHFFFAOYSA-N

• Lenalidomide
IUPAC Name: 3-(7-amino-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione | CAS Registry Number: 191732-72-6
Synonyms: Revlimid, Revimid, Revamid, IMiD3, Revlimid (TN), IMiD3 cpd, Lenalidomide [USAN], Lenalidomide (USAN/INN), CDC 501, CC-5013, Celgene brand of lenalidomide, Thalidomide analog CC-5013, STOCK6S-54938, CC 5013, ENMD-0997, IMID-5013, CDC-501, CDC-5013, CC5013, CID216326

Molecular Formula: C13H13N3O3Molecular Weight: 259.260620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GOTYRUGSSMKFNF-UHFFFAOYSA-N

• Letrozole
IUPAC Name: 4-[(4-cyanophenyl)-(1,2,4-triazol-1-yl)methyl]benzonitrile | CAS Registry Number: 112809-51-5
Synonyms: letrozole, Femara, Letrozol, Femera, F?mara, Femara (TN), Letrozole [USAN:INN], Prestwick0_001025, Prestwick1_001025, Prestwick2_001025, Prestwick3_001025, Novartis Brand of Letrozole, Letrozole (JAN/USP/INN), BSPBio_001209, MLS000759455, MLS001424038, SPBio_003070, CGS 20267, CGS-20267, BPBio1_001331

Molecular Formula: C17H11N5Molecular Weight: 285.302740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: HPJKCIUCZWXJDR-UHFFFAOYSA-N

• LINAGLIPTIN
IUPAC Name: 8-[(3R)-3-aminopiperidin-1-yl]-7-but-2-ynyl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]purine-2,6-dione | CAS Registry Number: 668270-12-0
Synonyms: Linagliptin, Ondero, CHEBI:499873, BI-1356-BS, BI 1356, BI-1356, CID10096344, CID 10096344, (R)-8-(3-Amino-piperidin-1-yl)-7-but-2-ynyl-3-methyl-1-(4-methyl-quinazolin-2-ylmethyl)-3,7-dihydro-purine-2,6-dione, (R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-1H-purine-2,6(3H,7H)-dione, 1H-Purine-2,6-dione, 8-((3R)-3-amino-1-piperidinyl)-7-(2-butynyl)-3,7-dihydro-3-methyl-1-((4-methyl-2-quinazolinyl)methyl)-

Molecular Formula: C25H28N8O2Molecular Weight: 472.542220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: LTXREWYXXSTFRX-QGZVFWFLSA-N

• Lobaplatin
IUPAC Name: [2-(aminomethyl)cyclobutyl]methanamine; 2-oxidopropanoate; platinum(2+) | CAS Registry Number: 135558-11-1
Synonyms: Lobaplatin [INN], Lobaplatine [INN-French], Lobaplatinum [INN-Latin], Lobaplatino [INN-Spanish], D 19466, cis-(trans-1,2-Cyclobutanebis(methylamine))((S)-lactato-O(sup 1),O(sup 1))platinum, Platinum, (1,2-cyclobutanedimethanamine-N,N')(2-hydroxypropanoato(2-)-O1,O2)-, (SP-4-3-(S),(trans))-, Platinum, (rel-(1R,2R)-1,2-cyclobutanedimethanamine-kappaN,kappaN')((2S)-2-(hydroxy-kappa-O)propanoato(2-)-kappaO)-, (SP-4-3)-

Molecular Formula: C9H18N2O3PtMolecular Weight: 397.328820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: RLXPIABKJFUYFG-UHFFFAOYSA-M

• Lomeguatrib
IUPAC Name: 6-[(4-bromothiophen-2-yl)methoxy]-7H-purin-2-amine | CAS Registry Number: 192441-08-0
Synonyms: PaTrin 2, Lomeguatrib [INN], UNII-S79265T71M, CHEBI:316928, 6-(4-Bromothenyloxy)-7H-purin-2-amine, CID3025944, LS-184193, 6-((4-bromo-2-thienyl)methoxy)purin-2-amine, 6-((4-Bromo-2-thienyl)methoxyl)purin-2-amine, C521206, 6-(4-Bromo-thiophen-2-ylmethoxy)-9H-purin-2-ylamine, 793035-44-6

Molecular Formula: C10H8BrN5OSMolecular Weight: 326.172420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: JUJPKFNFCWJBCX-UHFFFAOYSA-N

• Loperamide Hydrochloride
IUPAC Name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-N,N-dimethyl-2,2-di(phenyl)butanamide hydrochloride | CAS Registry Number: 34552-83-5
Synonyms: Imodium, Loperamide hydrochloride, Loperamide HCl, Dissenten, Fortasec, Suprasec, Lopemid, Lopemin, Loperyl, Imosec, Tebloc, Imodium A-D, Maalox Antidiarrheal, BLOX, BREK, Prestwick_302, Imodium (TN), IMODIUM ADVANCED, C29H33ClN2O2.HCl, MLS000069779

Molecular Formula: C29H34Cl2N2O2Molecular Weight: 513.498460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: PGYPOBZJRVSMDS-UHFFFAOYSA-N

• Lopinavir
IUPAC Name: (2S)-N-[(2S,4S,5S)-5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-di(phenyl)hexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide | CAS Registry Number: 192725-17-0
Synonyms: Aluviran, Kaletra, Koletra, Aluvia, Mixture Name, 1mui, ABT-378, Component of Kaletra, 2o4s, 2q5k, ABT 378, Lopinavir (JAN/USAN/INN), Lopinavir [USAN:INN:BAN], ABT-378, LOPINAVIR, RS-346, AIDS032937, C37H48N4O5, AIDS-032937, ABT 157378, DB01601

Molecular Formula: C37H48N4O5Molecular Weight: 628.800820 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: KJHKTHWMRKYKJE-SUGCFTRWSA-N

• LY2090314
Synonyms: Kinome_3681, SureCN633455, UNII-822M3GYM67, CHEMBL362558, CHEBI:411715, LY-2090314

Molecular Formula: C28H25FN6O3Molecular Weight: 512.534903 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: HRJWTAWVFDCTGO-UHFFFAOYSA-N

• LY2228820
IUPAC Name: 5-[2-tert-butyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine;methanesulfonic acid | CAS Registry Number: 862507-23-1
Synonyms: LY-2228820, LY-2228820, LY2228820, LY 2228820, Ralimetinib Mesylate, S1494_Selleck, UNII-QUW7B71FO9, AGN-PC-00BT9J, cc-430, CHEMBL2364627, LY2228820 2MsOH, MolPort-016-633-222, BCPP000179, BCP9000872, CS-0208, LSN-2322600, HY-13241, LY2228820-Supplied by Selleck Chemicals, FT-0670881, LY2228820|862507-23-1|LY2228820 2MsOH|LY 2228820|LY-2228820, 3H-Imidazo(4,5-b)pyridin-2-amine, 5-(2-(1,1-dimethylethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)-3-(2,2-dimethylpropyl)-, methanesulfonate (1:2)

Molecular Formula: C26H37FN6O6S2Molecular Weight: 612.736983 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: NARMJPIBAXVUIE-UHFFFAOYSA-N

• ly2603618 IC-83
IUPAC Name: 1-[5-bromo-4-methyl-2-[[(2S)-morpholin-2-yl]methoxy]phenyl]-3-(5-methylpyrazin-2-yl)urea | CAS Registry Number: 911222-45-2
Synonyms: LY2603618, Rabusertib, LY 2603618, LY-2603618, Rabusertib [USAN], Rabusertib (USAN/INN), SureCN304747, UNII-3S9L1NU6U7, cc-579, CHEMBL3039517, MolPort-021-804-967, BCPP000178, IC-83, BCP9000873, CS-0472, RL05730, NCGC00343768-01, HY-14720, LY2603618 - IC-83, D10397

Molecular Formula: C18H22BrN5O3Molecular Weight: 436.302980 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: SYYBDNPGDKKJDU-ZDUSSCGKSA-N

• LY2811376
IUPAC Name: (4S)-4-(2,4-difluoro-5-pyrimidin-5-ylphenyl)-4-methyl-5,6-dihydro-1,3-thiazin-2-amine | CAS Registry Number: 1194044-20-6
Synonyms: (S)-4-(2,4-Difluoro-5-(pyrimidin-5-yl)phenyl)-4-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine, S1528_Selleck, SureCN1422085, cc-359, CHEMBL2333941, CTK8B8766, ANW-61210, AKOS016003393, BCP9000876, CS-0987, RL00753, NCGC00346719-01, AK-55461, AM807940, HY-10472, LY-2811376, Y0285, LY2811376|1194044-20-6|LY-2811376, (4S)-4-[2,4-Difluoro-5-(5-pyrimidinyl)phenyl]-5,6-dihydro-4-methyl-4H-1,3-thiazin-2-amine, 4H-1,3-Thiazin-2-amine, 4-[2,4-difluoro-5-(5-pyrimidinyl)phenyl]-5,6-dihydro-4-methyl-, (4S)-

Molecular Formula: C15H14F2N4SMolecular Weight: 320.360266 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: MJQMRGWYPNIERM-HNNXBMFYSA-N

• LY2940680
IUPAC Name: 4-fluoro-N-methyl-N-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]-2-(trifluoromethyl)benzamide | CAS Registry Number: 1258861-20-9
Synonyms: LY-2940680, Taladegib, UNII-QY8BWX1LJ5, SureCN2128615, cc-431, CHEMBL2142592, BCP9000881, CS-0459, RL01260, NCGC00263170-01, HY-13242, LY 2940680, X7613, LY2940680|1258861-20-9|LY-2940680, 1258861-20-9 , LY 2940680 , LY-2940680, 1KS, 4-fluoro-n-methyl-n-(1-(4-(1-methyl-1h-pyrazol-5-yl)-1-phthalazinyl)-4-piperidinyl)-2-(trifluoromethyl)benzamide, 4-Fluoro-N-Methyl-N-{1-[4-(1-Methyl-1h-Pyrazol-5-Yl)phthalazin-1-Yl]piperidin-4-Yl}-2-(Trifluoromethyl)benzamide, 4-fluoro-N-methyl-N-{1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl}-2-(trifluoromethyl)benzamide, Benzamide, 4-fluoro-N-methyl-N-[1-[4-(1-methyl-1H-pyrazol-5-yl)-1-phthalazinyl]-4-piperidinyl]-2-(trifluoromethyl)-

Molecular Formula: C26H24F4N6OMolecular Weight: 512.501973 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 9

InChIKey: SZBGQDXLNMELTB-UHFFFAOYSA-N

• LY364947
IUPAC Name: 4-(5-pyridin-2-yl-1H-pyrazol-4-yl)quinoline | CAS Registry Number: 396129-53-6
Synonyms: 4-(3-PYRIDIN-2-YL-1H-PYRAZOL-4-YL)QUINOLINE, TbetaR-I Inhibitor, ALK5 Inhibitor I, LY-364947, TGF-beta RI Kinase Inhibitor, Transforming Growth Factor-beta Type I Receptor Kinase Inhibitor, LY 364947, [3-(Pyridin-2-yl)-4-(4-quinonyl)]-1H-pyrazole, PY1, 4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)quinoline, 4-[3-(pyridin-2-yl)-1H-pyrazol-4-yl]quinoline, HTS 466284, HTS-466284, 1py5, AC1L9LFY, Peakdale1_000394, SureCN373665, Ambpe3000655, cc-654, L6293_SIGMA

Molecular Formula: C17H12N4Molecular Weight: 272.303980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IBCXZJCWDGCXQT-UHFFFAOYSA-N

• MALONOBEN; 3,5-DI-TERT-BUTYL-4-HYDROXYBENZYLIDENEMALONONITRILE
IUPAC Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]propanedinitrile | CAS Registry Number: 10537-47-0
Synonyms: tyrphostin A9, Malonoben, Malonoben [ANSI], Caswell No. 291AA, Lopac-T-182, BiomolKI_000020, Gulf S-15126, BiomolKI2_000009, GCP 5126, Ambcb5272363, Neuro_000115, T182_SIGMA, CBiol_001719, ENT 27910, Lopac0_001254, Oprea1_168738, BSPBio_001200, KBioGR_000540, KBioSS_000540, MLS002153354

Molecular Formula: C18H22N2OMolecular Weight: 282.380080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MZOPWQKISXCCTP-UHFFFAOYSA-N


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