CFam Chemical Families Database
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You are searching for "CFAMM00277589" in compound.

Total 1 results found.

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CFAM Mol ID CFAMM00277589
Family CFFID2837 5-hydroxytryptamine receptor 2C Ligand N-(6-phenoxypyridin-3-yl)-1h-indole-3-carboxamide Family
Superfamily CFSCD472 5-hydroxytryptamine receptor 1A and Sodium-dependent serotonin transporter Ligand Vilazodone Superfamily
Class CFCAD656 Class 656
External ID CHEMBL523625 External Source CHEMBL
PubChem CID 42603752 Functional Category Bioactive
Molecule Name 2-[4-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]butyl]-4-(4-methylphenyl)pyrido[1,2-c]pyrimidine-1,3-dione
IUPAC Name 2-[4-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]butyl]-4-(4-methylphenyl)pyrido[1,2-c]pyrimidine-1,3-dione
Synonyms CHEBI:623849;AGN-PC-068411;2-[4-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]butyl]-4-(4-methylphenyl)pyrido[1,2-c]pyrimidine-1,3-dione
InChi InChI=1S/C33H36N4O3/c1-23-8-10-25(11-9-23)31-30-7-3-4-17-36(30)33(39)37(32(31)38)18-6-5-16-35-19-14-24(15-20-35)28-22-34-29-13-12-26(40-2)21-27(28)29/h3-4,7-13,17,21-22,24,34H,5-6,14-16,18-20H2,1-2H3
InChiKey HHXXLVSQRJPXFC-UHFFFAOYSA-N
Formula C33H36N4O3 Molecular Weight 536.66
Cross Link CHEMBL523625
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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