CFam Chemical Families Database
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You are searching for "CFAMM00033963" 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 CFAMM00033963
Family CFFAD188 D(2) dopamine receptor Ligand Nemonapride Family
Superfamily CFSAD176 D(2) dopamine receptor Ligand Nemonapride Superfamily
Class CFCAD171 Class 171
External ID CHEMBL432681 External Source CHEMBL
PubChem CID 44286505 Functional Category Bioactive
Molecule Name AGN-PC-073MCE
IUPAC Name 16-amino-17-chloro-7-ethyl-13-oxa-3,7-diazabicyclo[12.4.0]octadeca-1(18),14,16-trien-2-one
Synonyms CHEBI:158078;16-amino-17-chloro-7-ethyl-13-oxa-3,7-diazabicyclo[12.4.0]octadeca-1(18),14,16-trien-2-one
InChi InChI=1S/C17H26ClN3O2/c1-2-21-8-4-3-5-10-23-16-12-15(19)14(18)11-13(16)17(22)20-7-6-9-21/h11-12H,2-10,19H2,1H3,(H,20,22)
InChiKey WHVQUSLAQBLJHI-UHFFFAOYSA-N
Formula C17H26ClN3O2 Molecular Weight 339.86
Cross Link CHEMBL432681
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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