CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00018082" 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 CFAMM00018082
Family CFFAD92 Histamine H1 receptor ligand tricyclic antidepressant Loratadine Family
Superfamily CFSAD88 Histamine H1 receptor ligand tricyclic antidepressant Superfamily
Class CFCAD88 Class 88
External ID 44267115 External Source PubChem
PubChem CID 44267115 Functional Category Patent Compound
Molecule Name SureCN8878954
IUPAC Name 1-[11-(1-acetylpiperidin-4-ylidene)-8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-3-yl]ethanone
Synonyms CHEMBL11435;AGN-PC-0745B8;CHEBI:108335;1-[11-(1-acetylpiperidin-4-ylidene)-8-chloro-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridin-3-yl]ethanone
InChi InChI=1S/C23H23ClN2O2/c1-14(27)19-11-18-4-3-17-12-20(24)5-6-21(17)22(23(18)25-13-19)16-7-9-26(10-8-16)15(2)28/h5-6,11-13H,3-4,7-10H2,1-2H3
InChiKey DZOUZDARLWQOBO-UHFFFAOYSA-N
Formula C23H23ClN2O2 Molecular Weight 394.89
Cross Link CHEMBL11435
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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