CFam Chemical Families Database
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You are searching for "CFAMM00127268" 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 CFAMM00127268
Family CFFCD12 Serine/threonine-protein kinase Chk1 and Serine/threonine-protein kinase Chk2 Inhibitor XL844 Family
Superfamily CFSCD12 Serine/threonine-protein kinase Chk1 and Serine/threonine-protein kinase Chk2 Inhibitor XL844 Superfamily
Class CFCCD9 Class 822
External ID CHEMBL206213 External Source CHEMBL
PubChem CID 23646793 Functional Category Bioactive
Molecule Name N-pyrazinylurea Analog 8b
IUPAC Name N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxyphenyl]-3-ethoxypropanamide
Synonyms AGN-PC-046QR0;N-[2-chloro-4-[(5-cyanopyrazin-2-yl)carbamoylamino]-5-methoxyphenyl]-3-ethoxypropanamide
InChi InChI=1S/C18H19ClN6O4/c1-3-29-5-4-17(26)23-13-7-15(28-2)14(6-12(13)19)24-18(27)25-16-10-21-11(8-20)9-22-16/h6-7,9-10H,3-5H2,1-2H3,(H,23,26)(H2,22,24,25,27)
InChiKey DAHPYAQYEHCBNQ-UHFFFAOYSA-N
Formula C18H19ClN6O4 Molecular Weight 418.83
Cross Link CHEMBL206213
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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