CFam Chemical Families Database
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You are searching for "CFAMM00007324" in compound.

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CFAM Mol ID CFAMM00007324
Family CFFAD29 5-hydroxytryptamine receptor 1A ligand azapirone derivative Buspirone Family
Superfamily CFSAD29 5HT receptor binding azapirones Superfamily
Class CFCAD29 Class 29
External ID CHEMBL539570 External Source CHEMBL
PubChem CID 45265369 Functional Category Bioactive
Molecule Name AGN-PC-07C2FL
IUPAC Name N-methyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]adamantane-1-carboxamide;dihydrochloride
Synonyms N-methyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]adamantane-1-carboxamide;dihydrochloride
InChi InChI=1S/C22H33N5O.2ClH/c1-25(20(28)22-14-17-11-18(15-22)13-19(12-17)16-22)5-6-26-7-9-27(10-8-26)21-23-3-2-4-24-21;;/h2-4,17-19H,5-16H2,1H3;2*1H/t17-,18+,19-,22?;;
InChiKey FPJGRKGEQUJCHL-KHLLBTIYSA-N
Formula C22H35Cl2N5O Molecular Weight 456.45
Cross Link CHEMBL539570
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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