CFam Chemical Families Database
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You are searching for "CFAMM00189146" in compound.

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CFAM Mol ID CFAMM00189146
Family CFFID368 Cannabinoid receptor 2 Ligand JWH-167 Family
Superfamily CFSCD455 D(4) dopamine receptor Ligand SPI-376 Superfamily
Class CFCCD323 Class 1136
External ID 57040532 External Source PubChem
PubChem CID 57040532 Functional Category Patent Compound
Molecule Name AGN-PC-0BNPEL
IUPAC Name 4-[3-[3-[[cyano-[4-(2-methylpropyl)phenyl]methyl]amino]benzoyl]indol-1-yl]butanoic acid
Synonyms SureCN9337733;4-[3-[3-[[cyano-[4-(2-methylpropyl)phenyl]methyl]amino]benzoyl]indol-1-yl]butanoic acid
InChi InChI=1S/C31H31N3O3/c1-21(2)17-22-12-14-23(15-13-22)28(19-32)33-25-8-5-7-24(18-25)31(37)27-20-34(16-6-11-30(35)36)29-10-4-3-9-26(27)29/h3-5,7-10,12-15,18,20-21,28,33H,6,11,16-17H2,1-2H3,(H,35,36)
Formula C31H31N3O3 Molecular Weight 493.60
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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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