CFam Chemical Families Database
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You are searching for "CFAMM00452031" in compound.

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CFAM Mol ID CFAMM00452031
Family CFFBM19494 Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]-3-(4-pyridin-2-ylphenyl)propanoic acid family
Superfamily CFSBM6707 Integrin beta-1 and Integrin alpha-4 Binder Superfamily 21
Class CFCID1242 Class 2592
External ID CHEMBL91030 External Source CHEMBL
PubChem CID 44324774 Functional Category Bioactive
Molecule Name (2S)-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]-3-[4-(1H-indol-7-yl)phenyl]propanoic acid
IUPAC Name (2S)-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]-3-[4-(1H-indol-7-yl)phenyl]propanoic acid
Synonyms CHEBI:248671
InChi InChI=1S/C29H27Cl2N3O5S/c1-29(11-3-13-34(29)40(38,39)23-16-21(30)15-22(31)17-23)28(37)33-25(27(35)36)14-18-6-8-19(9-7-18)24-5-2-4-20-10-12-32-26(20)24/h2,4-10,12,15-17,25,32H,3,11,13-14H2,1H3,(H,33,37)(H,35,36)/t25-,29-/m0/s1
Formula C29H27Cl2N3O5S Molecular Weight 600.51
Cross Link CHEMBL91030

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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