CFam Chemical Families Database
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You are searching for "CFAMM00407339" in compound.

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CFAM Mol ID CFAMM00407339
Family CFFBM11176 D(4) dopamine receptor and 5-hydroxytryptamine receptor 1A ligand Piperazine, 1-phenyl-4-[(1-phenyl-1H-1,2,3-triazol-4-yl)methyl]- family
Superfamily CFSBM5400 Histone deacetylase 6 and Histone deacetylase 1 Binder Superfamily 5
Class CFCID1244 Class 2594
External ID CHEMBL484202 External Source CHEMBL
PubChem CID 25139479 Functional Category Bioactive
Molecule Name AGN-PC-04X2VX
IUPAC Name 4-ethynyl-N-[4-[4-(4-phenylphenyl)triazol-1-yl]butyl]-N-propylcyclohex-3-en-1-amine
Synonyms CHEBI:614330;4-ethynyl-N-[4-[4-(4-phenylphenyl)triazol-1-yl]butyl]-N-propylcyclohex-3-en-1-amine
InChi InChI=1S/C29H34N4/c1-3-20-32(28-18-12-24(4-2)13-19-28)21-8-9-22-33-23-29(30-31-33)27-16-14-26(15-17-27)25-10-6-5-7-11-25/h2,5-7,10-12,14-17,23,28H,3,8-9,13,18-22H2,1H3
InChiKey GOPCNWYYZCPBLJ-UHFFFAOYSA-N
Formula C29H34N4 Molecular Weight 438.61
Cross Link CHEMBL484202
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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