CFam Chemical Families Database
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You are searching for "CFAMM00289721" 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 CFAMM00289721
Family CFFID3370 D(2) dopamine receptor Ligand PD-135146 Family
Superfamily CFSID405 D(2) dopamine receptor and Interleukin-1 receptor type 1 Binder Superfamily
Class CFCCD101 Class 914
External ID DNC011599 External Source TTD
PubChem CID 15079637 Functional Category Investigative Drug
Molecule Name PD-135111
IUPAC Name 1-pyridin-2-yl-4-[2-(4-thiophen-2-ylcyclohex-3-en-1-yl)ethyl]piperazine
Synonyms SureCN9368439;CHEMBL346940;AGN-PC-003O46;CHEBI:363539;DNC011599;1-pyridin-2-yl-4-[2-(4-thiophen-2-ylcyclohex-3-en-1-yl)ethyl]piperazine
InChi InChI=1S/C21H27N3S/c1-2-11-22-21(5-1)24-15-13-23(14-16-24)12-10-18-6-8-19(9-7-18)20-4-3-17-25-20/h1-5,8,11,17-18H,6-7,9-10,12-16H2
InChiKey AAFWZBAPCZZXNP-UHFFFAOYSA-N
Formula C21H27N3S Molecular Weight 353.52
Cross Link CHEMBL346940
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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