CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00404143" in compound.

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CFAM Mol ID CFAMM00404143
Family CFFBM10747 Xanthine dehydrogenase/oxidase inhibitor 4-[[4-(2-aminopyrimidin-4-yl)-2-cyanophenoxy]methyl]cyclohexane-1-carboxylic acid family
Superfamily CFSCD599 SB1518 Superfamily
Class CFCCD18 Class 831
External ID 21247165 External Source PubChem
PubChem CID 21247165 Functional Category Patent Compound
Molecule Name SureCN10550400
IUPAC Name [4-(5-pentylpyrimidin-2-yl)phenyl] 3-cyano-4-hexoxybenzoate
Synonyms AGN-PC-0372IA;[4-(5-pentylpyrimidin-2-yl)phenyl] 3-cyano-4-hexoxybenzoate
InChi InChI=1S/C29H33N3O3/c1-3-5-7-9-17-34-27-16-13-24(18-25(27)19-30)29(33)35-26-14-11-23(12-15-26)28-31-20-22(21-32-28)10-8-6-4-2/h11-16,18,20-21H,3-10,17H2,1-2H3
Formula C29H33N3O3 Molecular Weight 471.59
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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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