CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00386356" 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.

Search Results

CFAM Mol ID CFAMM00386356
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 CHEMBL1796244 External Source CHEMBL
PubChem CID 56680184 Functional Category Bioactive
Molecule Name 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
IUPAC Name 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
Synonyms SureCN2060522
InChi InChI=1S/C23H33ClN6O2S/c1-3-30-12-10-16-8-9-18(14-17(16)11-13-30)26-23-25-15-19(24)22(28-23)27-20-6-4-5-7-21(20)29-33(2,31)32/h8-9,14-15,20-21,29H,3-7,10-13H2,1-2H3,(H2,25,26,27,28)/t20-,21-/m1/s1
InChiKey NKGBJFZCCPPWIY-NHCUHLMSSA-N
Formula C23H33ClN6O2S Molecular Weight 493.07
Cross Link CHEMBL1796244
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
 

 

27527 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00386356'),None, txtsearch, CFAMM00386356|