CFam Chemical Families Database
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You are searching for "CFAMM00428284" in compound.

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CFAM Mol ID CFAMM00428284
Family CFFBM14400 Epidermal growth factor receptor and Receptor tyrosine-protein kinase erbB-2 ligand AC1NS6DW family
Superfamily CFSBM89 Muscarinic acetylcholine receptor M1 and Aurora kinase A Binder Superfamily
Class CFCAD794 Class 794
External ID CHEMBL69966 External Source CHEMBL
PubChem CID 10300451 Functional Category Bioactive
Molecule Name 5-[(Z)-[4-(3-ethynylanilino)-6-oxo-7H-pyrrolo[2,3-d]pyrimidin-5-ylidene]methyl]-4-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-2-carboxamide
IUPAC Name 5-[(Z)-[4-(3-ethynylanilino)-6-oxo-7H-pyrrolo[2,3-d]pyrimidin-5-ylidene]methyl]-4-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-2-carboxamide
Synonyms pyrrolo[2,3-d]pyrimidin-6-one deriv. 26s
InChi InChI=1S/C27H27N7O3/c1-3-18-5-4-6-19(14-18)31-24-23-20(26(35)33-25(23)30-16-29-24)15-21-17(2)13-22(32-21)27(36)28-7-8-34-9-11-37-12-10-34/h1,4-6,13-16,32H,7-12H2,2H3,(H,28,36)(H2,29,30,31,33,35)/b20-15-
InChiKey ZJXFDKWJAGZFLT-HKWRFOASSA-N
Formula C27H27N7O3 Molecular Weight 497.55
Cross Link CHEMBL69966
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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