CFam Chemical Families Database
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You are searching for "CFAMM00372675" 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 CFAMM00372675
Family CFFBM6413 D(3) dopamine receptor and D(2) dopamine receptor ligand AGN-PC-03MZF5 family
Superfamily CFSID2099 D(2) dopamine receptor and D(3) dopamine receptor Ligand D-237 Superfamily
Class CFCAD182 Class 182
External ID CHEMBL157035 External Source CHEMBL
PubChem CID 22261340 Functional Category Bioactive
Molecule Name AGN-PC-03MZF5
IUPAC Name 7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butyl-prop-2-ynylamino]-5,6,7,8-tetrahydronaphthalen-2-ol
Synonyms CHEBI:361076;7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butyl-prop-2-ynylamino]-5,6,7,8-tetrahydronaphthalen-2-ol
InChi InChI=1S/C27H33Cl2N3O/c1-2-12-31(23-10-8-21-9-11-24(33)20-22(21)19-23)14-4-3-13-30-15-17-32(18-16-30)26-7-5-6-25(28)27(26)29/h1,5-7,9,11,20,23,33H,3-4,8,10,12-19H2
InChiKey PIHOPECZMJBZBU-UHFFFAOYSA-N
Formula C27H33Cl2N3O Molecular Weight 486.48
Cross Link CHEMBL157035
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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