CFam Chemical Families Database
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You are searching for "CFAMM00446289" in compound.

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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 CFAMM00446289
Family CFFBM18275 Dipeptidyl peptidase 4 and Cytochrome P450 2D6 inhibitor AGN-PC-07C1AI family
Superfamily CFSID405 D(2) dopamine receptor and Interleukin-1 receptor type 1 Binder Superfamily
Class CFCCD101 Class 914
External ID CHEMBL536086 External Source CHEMBL
PubChem CID 45263621 Functional Category Bioactive
Molecule Name AGN-PC-07C1AI
IUPAC Name 1-(6-thiophen-3-ylpyrimidin-4-yl)-4-(2,4,5-trifluorophenyl)pyrrolidin-3-amine;hydrochloride
Synonyms 1-(6-thiophen-3-ylpyrimidin-4-yl)-4-(2,4,5-trifluorophenyl)pyrrolidin-3-amine;hydrochloride
InChi InChI=1S/C18H15F3N4S.ClH/c19-13-4-15(21)14(20)3-11(13)12-6-25(7-16(12)22)18-5-17(23-9-24-18)10-1-2-26-8-10;/h1-5,8-9,12,16H,6-7,22H2;1H
InChiKey RZNQLFINCJHZDT-UHFFFAOYSA-N
Formula C18H16ClF3N4S Molecular Weight 412.86
Cross Link CHEMBL536086
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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