CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00442692" 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.

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CFAM Mol ID CFAMM00442692
Family CFFBM17458 Receptor tyrosine-protein kinase erbB-2 and Epidermal growth factor receptor ligand SureCN6238220 family
Superfamily CFSAD523 Epidermal growth factor receptor and Receptor tyrosine-protein kinase erbB-2 Inhibitor Lapatinib Superfamily
Class CFCAD481 Class 481
External ID CHEMBL500640 External Source CHEMBL
PubChem CID 44580971 Functional Category Bioactive
Molecule Name SureCN6238294
IUPAC Name [(3R,5S)-5-[2-[4-[3-chloro-4-[(3-fluorophenyl)methoxy]anilino]thieno[3,2-d]pyrimidin-6-yl]ethynyl]pyrrolidin-3-yl] ethyl carbonate
Synonyms CHEBI:594623
InChi InChI=1S/C28H24ClFN4O4S/c1-2-36-28(35)38-21-11-19(31-14-21)6-8-22-13-24-26(39-22)27(33-16-32-24)34-20-7-9-25(23(29)12-20)37-15-17-4-3-5-18(30)10-17/h3-5,7,9-10,12-13,16,19,21,31H,2,11,14-15H2,1H3,(H,32,33,34)/t19-,21-/m1/s1
Formula C28H24ClFN4O4S Molecular Weight 567.03
Cross Link CHEMBL500640

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).

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