CFAM Mol ID	CFAMM00376647
Family	CFFBM7035 RAC-alpha serine/threonine-protein kinase inhibitor 2-[(3,4-difluorophenyl)methyl]-1-[4-[(5S)-5-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-3-(propan-2-ylamino)propan-1-one family
Superfamily	CFSBM4004 Mitogen-activated protein kinase 9 and Mitogen-activated protein kinase 8 Binder Superfamily
Class	CFCBM1469 Class 4519
External ID	CHEMBL1632382	External Source	CHEMBL
PubChem CID	53319315	Functional Category	Bioactive
Molecule Name	1-[4-[(5S)-5-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-2-[(4-methylphenyl)methyl]-3-(propan-2-ylamino)propan-1-one
IUPAC Name	1-[4-[(5S)-5-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-2-[(4-methylphenyl)methyl]-3-(propan-2-ylamino)propan-1-one
Synonyms	CHEBI:1155473
InChi	InChI=1S/C25H35N5OS/c1-17(2)26-14-21(13-20-7-5-18(3)6-8-20)25(31)30-11-9-29(10-12-30)24-23-19(4)32-15-22(23)27-16-28-24/h5-8,16-17,19,21,26H,9-15H2,1-4H3/t19-,21?/m0/s1
InChiKey	FPCQIAFSAOSSKP-ZQRQZVKFSA-N
Formula	C25H35N5OS	Molecular Weight	453.64
Cross Link	CHEMBL1632382
Structure

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).

Last update by

2014.08.29

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore

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