CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00376663" 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 CFAMM00376663
Family CFFBM7038 Bifunctional epoxide hydrolase 2 inhibitor AGN-PC-088O2K family
Superfamily CFSBM4006 Bifunctional epoxide hydrolase 2 Binder Superfamily 8
Class CFCCD537 Class 1350
External ID CHEMBL1632487 External Source CHEMBL
PubChem CID 49850789 Functional Category Bioactive
Molecule Name AGN-PC-088O55
IUPAC Name 1-(1-adamantyl)-3-[3-[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]butoxy]phenyl]urea
Synonyms CHEBI:1155625;1-(1-adamantyl)-3-[3-[4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]butoxy]phenyl]urea
InChi InChI=1S/C32H44N4O4S/c1-24-7-9-30(10-8-24)41(38,39)36-14-12-35(13-15-36)11-2-3-16-40-29-6-4-5-28(20-29)33-31(37)34-32-21-25-17-26(22-32)19-27(18-25)23-32/h4-10,20,25-27H,2-3,11-19,21-23H2,1H3,(H2,33,34,37)
Formula C32H44N4O4S Molecular Weight 580.78
Cross Link CHEMBL1632487

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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