CFam Chemical Families Database
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You are searching for "CFAMM00159164" 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 CFAMM00159164
Family CFFCD465 D(4) dopamine receptor Ligand PD-165167 Family
Superfamily CFSCD425 D(4) dopamine receptor Ligand PD-165167 Superfamily
Class CFCAD615 Class 615
External ID CHEMBL350852 External Source CHEMBL
PubChem CID 44375855 Functional Category Bioactive
Molecule Name [2,6-di(propan-2-yl)phenyl] 3-[2,6-di(propan-2-yl)anilino]-3-oxopropanoate
IUPAC Name [2,6-di(propan-2-yl)phenyl] 3-[2,6-di(propan-2-yl)anilino]-3-oxopropanoate
Synonyms AGN-PC-07545P;CHEBI:370134;[2,6-di(propan-2-yl)phenyl] 3-[2,6-di(propan-2-yl)anilino]-3-oxopropanoate
InChi InChI=1S/C27H37NO3/c1-16(2)20-11-9-12-21(17(3)4)26(20)28-24(29)15-25(30)31-27-22(18(5)6)13-10-14-23(27)19(7)8/h9-14,16-19H,15H2,1-8H3,(H,28,29)
InChiKey LZPAYNSEMWKQKL-UHFFFAOYSA-N
Formula C27H37NO3 Molecular Weight 423.59
Cross Link CHEMBL350852
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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