CFam Chemical Families Database
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You are searching for "CFAMM00394436" in compound.

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CFAM Mol ID CFAMM00394436
Family CFFBM9313 5-hydroxytryptamine receptor 1A and 5-hydroxytryptamine receptor 7 ligand 3-[5-(3,4-dihydro-2H-chromen-2-ylmethylamino)pentyl]-1,3-thiazolidine-2,4-dione;hydrochloride family
Superfamily CFSID2171 Amine oxidase [flavin-containing] A and Amine oxidase [flavin-containing] B Inhibitor (+/-)-2-(4'-butoxyphenyl)thiomorpholin-5-one Superfamily
Class CFCAD412 Class 412
External ID CHEMBL1926749 External Source CHEMBL
PubChem CID 56850664 Functional Category Bioactive
Molecule Name 3-[4-(3,4-dihydro-2H-chromen-2-ylmethylamino)butyl]-1,3-thiazolidine-2,4-dione;hydrochloride
IUPAC Name 3-[4-(3,4-dihydro-2H-chromen-2-ylmethylamino)butyl]-1,3-thiazolidine-2,4-dione;hydrochloride
Synonyms AGN-PC-0BJEED;3-[4-(3,4-dihydro-2H-chromen-2-ylmethylamino)butyl]-1,3-thiazolidine-2,4-dione;hydrochloride
InChi InChI=1S/C17H22N2O3S.ClH/c20-16-12-23-17(21)19(16)10-4-3-9-18-11-14-8-7-13-5-1-2-6-15(13)22-14;/h1-2,5-6,14,18H,3-4,7-12H2;1H
InChiKey GREKBCSYJOUNLX-UHFFFAOYSA-N
Formula C17H23ClN2O3S Molecular Weight 370.89
Cross Link CHEMBL1926749
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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