CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00371174" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00371174
Family CFFBM6258 Integrin beta-1 and Integrin alpha-4 inhibitor SureCN6367561 family
Superfamily CFSBM3534 Integrin beta-1 and Integrin alpha-4 Binder Superfamily 3
Class CFCID1105 Class 2455
External ID CHEMBL313632 External Source CHEMBL
PubChem CID 44324488 Functional Category Bioactive
Molecule Name (2S)-3-[4-(2-cyano-6-methoxyphenyl)phenyl]-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]propanoic acid
IUPAC Name (2S)-3-[4-(2-cyano-6-methoxyphenyl)phenyl]-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]propanoic acid
Synonyms CHEBI:247985
InChi InChI=1S/C29H27Cl2N3O6S/c1-29(11-4-12-34(29)41(38,39)23-15-21(30)14-22(31)16-23)28(37)33-24(27(35)36)13-18-7-9-19(10-8-18)26-20(17-32)5-3-6-25(26)40-2/h3,5-10,14-16,24H,4,11-13H2,1-2H3,(H,33,37)(H,35,36)/t24-,29-/m0/s1
Formula C29H27Cl2N3O6S Molecular Weight 616.51
Cross Link CHEMBL313632

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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