CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00449750" in compound.

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CFAM Mol ID CFAMM00449750
Family CFFBM18920 Integrin beta-1 and Integrin alpha-5 inhibitor 2-[(2,6-dimethylbenzoyl)amino]-3-[4-[4-[(pyridin-2-ylamino)methyl]piperidin-1-yl]phenyl]propanoic acid family
Superfamily CFSBM1191 Integrin beta-1 and Integrin alpha-5 Binder Superfamily
Class CFCAD639 Class 639
External ID CHEMBL594161 External Source CHEMBL
PubChem CID 46226897 Functional Category Bioactive
Molecule Name (2S)-3-[4-[4-[[(4-methylpyridin-2-yl)amino]methyl]triazol-1-yl]phenyl]-2-[(2,4,6-trimethylbenzoyl)amino]propanoic acid
IUPAC Name (2S)-3-[4-[4-[[(4-methylpyridin-2-yl)amino]methyl]triazol-1-yl]phenyl]-2-[(2,4,6-trimethylbenzoyl)amino]propanoic acid
Synonyms SureCN8225065
InChi InChI=1S/C28H30N6O3/c1-17-9-10-29-25(13-17)30-15-22-16-34(33-32-22)23-7-5-21(6-8-23)14-24(28(36)37)31-27(35)26-19(3)11-18(2)12-20(26)4/h5-13,16,24H,14-15H2,1-4H3,(H,29,30)(H,31,35)(H,36,37)/t24-/m0/s1
Formula C28H30N6O3 Molecular Weight 498.58
Cross Link CHEMBL594161

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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National University of Singapore, Singapore

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