CFam Chemical Families Database
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You are searching for "CFAMM00134249" in compound.

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CFAM Mol ID CFAMM00134249
Family CFFCD108 Aurora kinase A Inhibitor MLN8054 Family
Superfamily CFSCD98 Aurora kinase A Inhibitor MLN8054 Superfamily
Class CFCCD85 Class 898
External ID DCL000170 External Source TTD
PubChem CID 24771867 Functional Category Clinical Trial Drug
Molecule Name MLN8237
IUPAC Name 4-[[9-chloro-7-(2-fluoro-6-methoxyphenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]-2-methoxybenzoic acid
Synonyms 1028486-01-2;MLN8237;MLN-8237;MLN 8237;MLN-8237, MLN8237;4-((9-Chloro-7-(2-fluoro-6-methoxyphenyl)-5H-benzo[c]pyrimido[4,5-e]azepin-2-yl)amino)-2-methoxybenzoic acid;MLN 8237, 1028486-01-2;4-[[9-Chloro-7-(2-fluoro-6-methoxyphenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]-2-methoxybenzoic acid;Alisertib (USAN);S1133_Selleck
InChi InChI=1S/C27H20ClFN4O4/c1-36-21-5-3-4-20(29)23(21)25-19-10-15(28)6-8-17(19)24-14(12-30-25)13-31-27(33-24)32-16-7-9-18(26(34)35)22(11-16)37-2/h3-11,13H,12H2,1-2H3,(H,34,35)(H,31,32,33)
Formula C27H20ClFN4O4 Molecular Weight 518.92
Cross Link CHEMBL483158

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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