CFam Chemical Families Database
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You are searching for "CFAMM00439174" in compound.

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CFAM Mol ID CFAMM00439174
Family CFFBM16727 Glycogen synthase kinase-3 beta and Glycogen synthase kinase-3 alpha inhibitor 4-[[4-[(3-hydroxy-1-adamantyl)amino]-5-nitropyrimidin-2-yl]amino]benzoic acid family
Superfamily CFSBM6915 Beta-lactamase and Lysosomal alpha-glucosidase Binder Superfamily 5
Class CFCCD85 Class 898
External ID CHEMBL404175 External Source CHEMBL
PubChem CID 44448694 Functional Category Bioactive
Molecule Name 3-[4-[[4-(1-adamantylamino)-5-nitropyrimidin-2-yl]amino]phenyl]propanoic acid
IUPAC Name 3-[4-[[4-(1-adamantylamino)-5-nitropyrimidin-2-yl]amino]phenyl]propanoic acid
InChi InChI=1S/C23H27N5O4/c29-20(30)6-3-14-1-4-18(5-2-14)25-22-24-13-19(28(31)32)21(26-22)27-23-10-15-7-16(11-23)9-17(8-15)12-23/h1-2,4-5,13,15-17H,3,6-12H2,(H,29,30)(H2,24,25,26,27)
Formula C23H27N5O4 Molecular Weight 437.49
Cross Link CHEMBL404175

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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