CFam Chemical Families Database
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You are searching for "CFAMM00386360" in compound.

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CFAM Mol ID CFAMM00386360
Family CFFBM8219 ALK tyrosine kinase receptor and Insulin receptor ligand N-[(1R,2R)-2-[[5-chloro-2-[(3-ethyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)amino]pyrimidin-4-yl]amino]cyclohexyl]methanesulfonamide family
Superfamily CFSBM4448 Insulin receptor and ALK tyrosine kinase receptor Binder Superfamily
Class CFCCD521 Class 1334
External ID CHEMBL1796251 External Source CHEMBL
PubChem CID 56666620 Functional Category Bioactive
Molecule Name N-[(1R,2R)-2-[[5-chloro-2-[[3-(2-methoxyethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]amino]pyrimidin-4-yl]amino]cyclohexyl]-2,2,2-trifluoroethanesulfonamide
IUPAC Name N-[(1R,2R)-2-[[5-chloro-2-[[3-(2-methoxyethyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]amino]pyrimidin-4-yl]amino]cyclohexyl]-2,2,2-trifluoroethanesulfonamide
Synonyms SureCN2061497
InChi InChI=1S/C25H34ClF3N6O3S/c1-38-13-12-35-10-8-17-6-7-19(14-18(17)9-11-35)31-24-30-15-20(26)23(33-24)32-21-4-2-3-5-22(21)34-39(36,37)16-25(27,28)29/h6-7,14-15,21-22,34H,2-5,8-13,16H2,1H3,(H2,30,31,32,33)/t21-,22-/m1/s1
InChiKey WHUMNDGRLJYAMI-FGZHOGPDSA-N
Formula C25H34ClF3N6O3S Molecular Weight 591.09
Cross Link CHEMBL1796251
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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