CFam Chemical Families Database
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You are searching for "CFAMM00231077" 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 CFAMM00231077
Family CFFID1184 D(2) dopamine receptor and D(3) dopamine receptor Ligand [2-(1h-benzoimidazol-4-yloxy)-ethyl]-benzyl-amine Family
Superfamily CFSID959 D(2) dopamine receptor and D(3) dopamine receptor Ligand [2-(1h-benzoimidazol-4-yloxy)-ethyl]-benzyl-amine Superfamily
Class CFCID664 Class 2014
External ID CHEMBL2393143 External Source CHEMBL
PubChem CID 46917844 Functional Category Bioactive
Molecule Name 3-[2-(difluoromethyl)-1-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)benzimidazol-4-yl]oxypropane-1,2-diol
IUPAC Name 3-[2-(difluoromethyl)-1-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)benzimidazol-4-yl]oxypropane-1,2-diol
Synonyms SureCN2820820;AGN-PC-080Y5H;3-[2-(difluoromethyl)-1-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)benzimidazol-4-yl]oxypropane-1,2-diol
InChi InChI=1S/C22H27F2N7O5/c23-18(24)19-25-17-15(2-1-3-16(17)36-13-14(33)12-32)31(19)22-27-20(29-4-8-34-9-5-29)26-21(28-22)30-6-10-35-11-7-30/h1-3,14,18,32-33H,4-13H2
InChiKey YCVKHDKWZXXMCB-UHFFFAOYSA-N
Formula C22H27F2N7O5 Molecular Weight 507.49
Cross Link CHEMBL2393143
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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