CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00483564" 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.

Search Results

CFAM Mol ID CFAMM00483564
Family CFFBM27656 5-hydroxytryptamine receptor 2C and 5-hydroxytryptamine receptor 2A ligand AGN-PC-074JPT family
Superfamily CFSID2442 Reverse transcriptase Inhibitor R-82913 Superfamily
Class CFCID34 Class 1384
External ID CHEMBL310497 External Source CHEMBL
PubChem CID 44315994 Functional Category Bioactive
Molecule Name AGN-PC-074JP6
IUPAC Name 9-chloro-7-(2-methylphenyl)-2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indole
Synonyms CHEBI:224059;9-chloro-7-(2-methylphenyl)-2,3,4,5,11,11a-hexahydro-1H-[1,4]diazepino[1,7-a]indole
InChi InChI=1S/C19H21ClN2/c1-13-4-2-3-5-17(13)18-12-15(20)10-14-11-16-6-7-21-8-9-22(16)19(14)18/h2-5,10,12,16,21H,6-9,11H2,1H3
InChiKey ZYPZBXUONFYJKI-UHFFFAOYSA-N
Formula C19H21ClN2 Molecular Weight 312.84
Cross Link CHEMBL310497
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
 

 

27509 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00483564'),None, txtsearch, CFAMM00483564|