CFam Chemical Families Database
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You are searching for "CFAMM00129429" in compound.

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CFAM Mol ID CFAMM00129429
Family CFFCD28 Transient receptor potential cation channel subfamily V member 1 Ligand AMG-517 Family
Superfamily CFSCD26 Transient receptor potential cation channel subfamily V member 1 Ligand AMG-517 Superfamily
Class CFCCD21 Class 834
External ID CHEMBL251565 External Source CHEMBL
PubChem CID 11692952 Functional Category Bioactive
Molecule Name tert-butyl 4-[4-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]-6-[4-(trifluoromethyl)phenyl]pyrimidin-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate
IUPAC Name tert-butyl 4-[4-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]-6-[4-(trifluoromethyl)phenyl]pyrimidin-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate
Synonyms AGN-PC-00E944;CHEBI:517830;tert-butyl 4-[4-[(2-acetamido-1,3-benzothiazol-4-yl)oxy]-6-[4-(trifluoromethyl)phenyl]pyrimidin-2-yl]-3,6-dihydro-2H-pyridine-1-carboxylate
InChi InChI=1S/C30H28F3N5O4S/c1-17(39)34-27-37-25-22(6-5-7-23(25)43-27)41-24-16-21(18-8-10-20(11-9-18)30(31,32)33)35-26(36-24)19-12-14-38(15-13-19)28(40)42-29(2,3)4/h5-12,16H,13-15H2,1-4H3,(H,34,37,39)
InChiKey CMZKNMDGKXXRFF-UHFFFAOYSA-N
Formula C30H28F3N5O4S Molecular Weight 611.63
Cross Link CHEMBL251565
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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