CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00045667" 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 CFAMM00045667
Family CFFAD270 Histamine H1 receptor ligand tricyclic antidepressant Desloratadine Family
Superfamily CFSAD88 Histamine H1 receptor ligand tricyclic antidepressant Superfamily
Class CFCAD88 Class 88
External ID CHEMBL1784617 External Source CHEMBL
PubChem CID 54585282 Functional Category Bioactive
Molecule Name AGN-PC-0A9TD8
IUPAC Name 3-chloro-5-(2-pyridin-2-ylethynyl)benzonitrile
Synonyms SureCN5652711;CHEBI:1251295;Benzonitrile, 3-chloro-5-(2-pyridinylethynyl)-
InChi InChI=1S/C14H7ClN2/c15-13-8-11(7-12(9-13)10-16)4-5-14-3-1-2-6-17-14/h1-3,6-9H
Formula C14H7ClN2 Molecular Weight 238.67
Cross Link CHEMBL1784617

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).

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National University of Singapore, Singapore

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