CFam Chemical Families Database
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You are searching for "CFAMM00161833" 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 CFAMM00161833
Family CFFCD514 Substance-P receptor Ligand Vestipitant Family
Superfamily CFSCD471 Substance-P receptor Ligand Vestipitant Superfamily
Class CFCCD335 Class 1148
External ID CHEMBL374452 External Source CHEMBL
PubChem CID 16125331 Functional Category Bioactive
Molecule Name SureCN13945825
IUPAC Name 1-[1-methyl-1-(3-phenylpropyl)pyrrolidin-1-ium-3-yl]-4,4-diphenylimidazolidin-2-one
Synonyms CHEBI:471369
InChi InChI=1S/C29H33N3O/c1-32(20-11-14-24-12-5-2-6-13-24)21-19-27(22-32)31-23-29(30-28(31)33,25-15-7-3-8-16-25)26-17-9-4-10-18-26/h2-10,12-13,15-18,27H,11,14,19-23H2,1H3/p+1
InChiKey MKNASJNZVVEVJG-UHFFFAOYSA-O
Formula C29H34N3O Molecular Weight 440.60
Cross Link CHEMBL374452
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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