CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00366291" in compound.

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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 CFAMM00366291
Family CFFBM5793 Bifunctional dihydrofolate reductase-thymidylate synthase and Dihydrofolate reductase inhibitor AC1LA0CK family
Superfamily CFSBM492 Dihydrofolate reductase and Dual specificity protein kinase TTK Binder Superfamily
Class CFCCD18 Class 831
External ID CHEMBL523436 External Source CHEMBL
PubChem CID 44565033 Functional Category Bioactive
Molecule Name AGN-PC-078XOF
IUPAC Name 2-(cyclopropylamino)-9-(3-methoxyphenyl)-7-(1-phenylethyl)purin-8-one
Synonyms SureCN13966205;CHEBI:557859;2-(cyclopropylamino)-9-(3-methoxyphenyl)-7-(1-phenylethyl)purin-8-one
InChi InChI=1S/C23H23N5O2/c1-15(16-7-4-3-5-8-16)27-20-14-24-22(25-17-11-12-17)26-21(20)28(23(27)29)18-9-6-10-19(13-18)30-2/h3-10,13-15,17H,11-12H2,1-2H3,(H,24,25,26)
Formula C23H23N5O2 Molecular Weight 401.46
Cross Link CHEMBL523436

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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