CFam Chemical Families Database
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You are searching for "CFAMM00456453" in compound.

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CFAM Mol ID CFAMM00456453
Family CFFBM20612 5-hydroxytryptamine receptor 7 ligand 4-[4-(2-ethoxyphenyl)piperazin-1-yl]-N-[[7-fluoro-3-(3-methoxyphenyl)-4-oxoquinazolin-2-yl]methyl]butanamide family
Superfamily CFSBM1205 C-C chemokine receptor type 3 and 5-hydroxytryptamine receptor 7 Binder Superfamily
Class CFCID107 Class 1457
External ID ZINC03532866 External Source ZINC
PubChem CID 2648523 Functional Category Natural Product
Molecule Name N-(2,4-dimethoxyphenyl)-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
IUPAC Name N-(2,4-dimethoxyphenyl)-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide
Synonyms AC1MBBON;STOCK1N-73981;MolPort-006-820-187;AKOS001763981;MCULE-4640868364;N-(2,4-dimethoxyphenyl)-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide
InChi InChI=1S/C22H23N3O4/c1-28-15-8-10-17(19(13-15)29-2)24-21(26)14-7-9-16-18(12-14)23-20-6-4-3-5-11-25(20)22(16)27/h7-10,12-13H,3-6,11H2,1-2H3,(H,24,26)
InChiKey WKZMWSYEUVPIPD-UHFFFAOYSA-N
Formula C22H23N3O4 Molecular Weight 393.44
Cross Link
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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