CFam Chemical Families Database
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You are searching for "CFAMM00402368" 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 CFAMM00402368
Family CFFBM10470 Bifunctional epoxide hydrolase 2 inhibitor Urea-based compound, 20 family
Superfamily CFSBM5182 Bifunctional epoxide hydrolase 2 Binder Superfamily 9
Class CFCID1066 Class 2416
External ID CHEMBL244406 External Source CHEMBL
PubChem CID 16757353 Functional Category Bioactive
Molecule Name AGN-PC-015I1C
IUPAC Name 3-[4-(1-adamantylcarbamoylamino)cyclohexyl]oxybenzoic acid
Synonyms CHEBI:487288;3-[4-(1-adamantylcarbamoylamino)cyclohexyl]oxybenzoic acid
InChi InChI=1S/C24H32N2O4/c27-22(28)18-2-1-3-21(11-18)30-20-6-4-19(5-7-20)25-23(29)26-24-12-15-8-16(13-24)10-17(9-15)14-24/h1-3,11,15-17,19-20H,4-10,12-14H2,(H,27,28)(H2,25,26,29)/t15?,16?,17?,19-,20+,24?
InChiKey MURDWSCWZJZGCX-UWAHDGMKSA-N
Formula C24H32N2O4 Molecular Weight 412.52
Cross Link CHEMBL244406
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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