CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00218537" 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 CFAMM00218537
Family CFFID770 Epidermal growth factor receptor and Receptor tyrosine-protein kinase erbB-2 Inhibitor PD-168393 Family
Superfamily CFSID630 Epidermal growth factor receptor and Metabotropic glutamate receptor 5 Binder Superfamily
Class CFCAD202 Class 202
External ID CHEMBL140561 External Source CHEMBL
PubChem CID 5329085 Functional Category Bioactive
Molecule Name 6-Substituted 4-Anilinoquinazoline 24
IUPAC Name 3-(dimethylamino)propyl (E)-4-[[4-(3-bromoanilino)quinazolin-6-yl]amino]-4-oxobut-2-enoate
Synonyms AC1NS614;3-(dimethylamino)propyl (E)-4-[[4-(3-bromoanilino)quinazolin-6-yl]amino]-4-oxobut-2-enoate
InChi InChI=1S/C23H24BrN5O3/c1-29(2)11-4-12-32-22(31)10-9-21(30)27-18-7-8-20-19(14-18)23(26-15-25-20)28-17-6-3-5-16(24)13-17/h3,5-10,13-15H,4,11-12H2,1-2H3,(H,27,30)(H,25,26,28)/b10-9+
Formula C23H24BrN5O3 Molecular Weight 498.37
Cross Link CHEMBL140561

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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National University of Singapore, Singapore

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