CFam Chemical Families Database
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You are searching for "CFAMM00308161" 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 CFAMM00308161
Family CFFBM156 Cyclin-dependent kinase 2 and Cyclin-dependent kinase 1 inhibitor AC1O6YZF family
Superfamily CFSBM97 D(4) dopamine receptor and D(2) dopamine receptor Binder Superfamily
Class CFCBM4 Class 3054
External ID CHEMBL100391 External Source CHEMBL
PubChem CID 6539005 Functional Category Bioactive
Molecule Name 2,4-bis anilino pyrimidine deriv. 22
IUPAC Name 1-[4-[(4-anilino-5-chloropyrimidin-2-yl)amino]phenoxy]-3-(dimethylamino)propan-2-ol
Synonyms AC1O6YZ5;SureCN14632119;1-[4-[(4-anilino-5-chloropyrimidin-2-yl)amino]phenoxy]-3-(dimethylamino)propan-2-ol
InChi InChI=1S/C21H24ClN5O2/c1-27(2)13-17(28)14-29-18-10-8-16(9-11-18)25-21-23-12-19(22)20(26-21)24-15-6-4-3-5-7-15/h3-12,17,28H,13-14H2,1-2H3,(H2,23,24,25,26)
InChiKey WVTQEDQHWYJROA-UHFFFAOYSA-N
Formula C21H24ClN5O2 Molecular Weight 413.90
Cross Link CHEMBL100391
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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