CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00161796" in compound.

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CFAM Mol ID CFAMM00161796
Family CFFCD514 Substance-P receptor Ligand Vestipitant Family
Superfamily CFSCD471 Substance-P receptor Ligand Vestipitant Superfamily
Class CFCCD335 Class 1148
External ID CHEMBL182940 External Source CHEMBL
PubChem CID 44392235 Functional Category Bioactive
Molecule Name AGN-PC-075E4S
IUPAC Name 1-[1-(3,3-diphenylpropyl)piperidin-4-yl]-1-ethyl-3-[(3-methylphenyl)methyl]urea
Synonyms CHEBI:405263;1-[1-(3,3-diphenylpropyl)piperidin-4-yl]-1-ethyl-3-[(3-methylphenyl)methyl]urea
InChi InChI=1S/C31H39N3O/c1-3-34(31(35)32-24-26-12-10-11-25(2)23-26)29-17-20-33(21-18-29)22-19-30(27-13-6-4-7-14-27)28-15-8-5-9-16-28/h4-16,23,29-30H,3,17-22,24H2,1-2H3,(H,32,35)
Formula C31H39N3O Molecular Weight 469.66
Cross Link CHEMBL182940

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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