CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00421181" in compound.

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CFAM Mol ID CFAMM00421181
Family CFFBM13232 Renin and Cytochrome P450 3A4 inhibitor AGN-PC-046RG9 family
Superfamily CFSID1584 Melanin-concentrating hormone receptor 1 Binder Superfamily
Class CFCID896 Class 2246
External ID CHEMBL239078 External Source CHEMBL
PubChem CID 23647892 Functional Category Bioactive
Molecule Name AGN-PC-046RG9
IUPAC Name N-[2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2-(2,5-difluorophenyl)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]ethyl]acetamide
Synonyms 1,4-benzoxazin-3-one, 32;N-[2-[6-(2,4-diamino-6-ethylpyrimidin-5-yl)-2-(2,5-difluorophenyl)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]ethyl]acetamide
InChi InChI=1S/C25H26F2N6O3/c1-4-18-21(22(28)32-24(29)31-18)14-5-8-20-19(11-14)33(10-9-30-13(2)34)23(35)25(3,36-20)16-12-15(26)6-7-17(16)27/h5-8,11-12H,4,9-10H2,1-3H3,(H,30,34)(H4,28,29,31,32)
Formula C25H26F2N6O3 Molecular Weight 496.51
Cross Link CHEMBL239078

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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