CFam Chemical Families Database
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You are searching for "CFAMM00446346" in compound.

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CFAM Mol ID CFAMM00446346
Family CFFBM18287 5-hydroxytryptamine receptor 2C and 5-hydroxytryptamine receptor 2A ligand AGN-PC-07C1H6 family
Superfamily CFSBM2449 5-hydroxytryptamine receptor 2A and 5-hydroxytryptamine receptor 2C Binder Superfamily 6
Class CFCBM380 Class 3430
External ID CHEMBL543253 External Source CHEMBL
PubChem CID 45259321 Functional Category Bioactive
Molecule Name AGN-PC-07BY8M
IUPAC Name 3-[4-[4-(2-bromothieno[3,2-c]pyridin-4-yl)piperazin-1-yl]butyl]-1-thia-3-azaspiro[4.4]nonane-2,4-dione;hydrochloride
Synonyms 3-[4-[4-(2-bromothieno[3,2-c]pyridin-4-yl)piperazin-1-yl]butyl]-1-thia-3-azaspiro[4.4]nonane-2,4-dione;hydrochloride
InChi InChI=1S/C22H27BrN4O2S2.ClH/c23-18-15-16-17(30-18)5-8-24-19(16)26-13-11-25(12-14-26)9-3-4-10-27-20(28)22(31-21(27)29)6-1-2-7-22;/h5,8,15H,1-4,6-7,9-14H2;1H
InChiKey BZPMREASAJYKTR-UHFFFAOYSA-N
Formula C22H28BrClN4O2S2 Molecular Weight 559.97
Cross Link CHEMBL543253
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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