CFam Chemical Families Database
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You are searching for "CFAMM00235942" 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.

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CFAM Mol ID CFAMM00235942
Family CFFID1333 5-hydroxytryptamine receptor 2A and Alpha-1A adrenergic receptor Ligand Isoclozapine Family
Superfamily CFSID1065 5-hydroxytryptamine receptor 2A and Alpha-1A adrenergic receptor Ligand Isoclozapine Superfamily
Class CFCID677 Class 2027
External ID CHEMBL386424 External Source CHEMBL
PubChem CID 44415394 Functional Category Bioactive
Molecule Name (E)-N-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-3-phenylprop-2-enamide
IUPAC Name (E)-N-[3-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-3-phenylprop-2-enamide
Synonyms CHEBI:456811
InChi InChI=1S/C27H26ClN5O/c1-31-15-17-32(18-16-31)27-22-9-5-6-10-24(22)33(25-13-12-21(28)19-23(25)29-27)30-26(34)14-11-20-7-3-2-4-8-20/h2-14,19H,15-18H2,1H3,(H,30,34)/b14-11+
InChiKey SRVIPQXGTQCEKQ-SDNWHVSQSA-N
Formula C27H26ClN5O Molecular Weight 471.98
Cross Link CHEMBL386424
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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