CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00192522" in compound.

Total 1 results found.

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 CFAMM00192522
Family CFFID460 5-hydroxytryptamine receptor 1A Ligand P-MPPI Family
Superfamily CFSID375 5-hydroxytryptamine receptor 1A and Peptidyl-prolyl cis-trans isomerase A Binder Superfamily
Class CFCID262 Class 1612
External ID CHEMBL1774990 External Source CHEMBL
PubChem CID 54579954 Functional Category Bioactive
Molecule Name AGN-PC-09OF4T
IUPAC Name 3-iodo-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N-pyridin-2-yladamantane-1-carboxamide
Synonyms CHEBI:1246043;(5R,7S)-3-iodo-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N-pyridin-2-yladamantane-1-carboxamide
InChi InChI=1S/C29H37IN4O2/c1-36-25-7-3-2-6-24(25)33-13-10-32(11-14-33)12-15-34(26-8-4-5-9-31-26)27(35)28-17-22-16-23(18-28)20-29(30,19-22)21-28/h2-9,22-23H,10-21H2,1H3
InChiKey UUEYSWOZRCNJJP-UHFFFAOYSA-N
Formula C29H37IN4O2 Molecular Weight 600.53
Cross Link CHEMBL1774990
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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