CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00310814" in compound.

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CFAM Mol ID CFAMM00310814
Family CFFBM363 Bifunctional epoxide hydrolase 2 and Cytochrome P450 3A4 inhibitor SureCN13211230 family
Superfamily CFSBM230 Cannabinoid receptor 1 and Cannabinoid receptor 2 Binder Superfamily 2
Class CFCBM85 Class 3135
External ID CHEMBL472299 External Source CHEMBL
PubChem CID 44560203 Functional Category Bioactive
Molecule Name AGN-PC-078UJU
IUPAC Name N-tert-butyl-4-[(4-chlorophenyl)-(2,3-dichlorophenyl)methyl]piperazine-1-carboxamide
Synonyms CHEBI:546958;N-tert-butyl-4-[(4-chlorophenyl)-(2,3-dichlorophenyl)methyl]piperazine-1-carboxamide
InChi InChI=1S/C22H26Cl3N3O/c1-22(2,3)26-21(29)28-13-11-27(12-14-28)20(15-7-9-16(23)10-8-15)17-5-4-6-18(24)19(17)25/h4-10,20H,11-14H2,1-3H3,(H,26,29)
Formula C22H26Cl3N3O Molecular Weight 454.82
Cross Link CHEMBL472299

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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