CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00218565" in compound.

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CFAM Mol ID CFAMM00218565
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 CHEMBL2112369 External Source CHEMBL
PubChem CID 5328989 Functional Category Bioactive
Molecule Name 4-anilinoquinazoline deriv. 27
IUPAC Name (Z)-N-[4-(3-bromoanilino)quinazolin-6-yl]-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]but-2-enamide
Synonyms AC1NS5T4;(Z)-N-[4-(3-bromoanilino)quinazolin-6-yl]-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]but-2-enamide
InChi InChI=1S/C24H26BrN5O2/c1-32-15-20-7-3-11-30(20)12-4-8-23(31)28-19-9-10-22-21(14-19)24(27-16-26-22)29-18-6-2-5-17(25)13-18/h2,4-6,8-10,13-14,16,20H,3,7,11-12,15H2,1H3,(H,28,31)(H,26,27,29)/b8-4-/t20-/m0/s1
Formula C24H26BrN5O2 Molecular Weight 496.40
Cross Link CHEMBL2112369

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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