CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00453172" 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 CFAMM00453172
Family CFFBM19805 Toll-like receptor 7 ligand SureCN2060223 family
Superfamily CFSBM511 Toll-like receptor 7 and Sterol O-acyltransferase 1 Binder Superfamily
Class CFCBM197 Class 3247
External ID CHEMBL1090529 External Source CHEMBL
PubChem CID 46196913 Functional Category Bioactive
Molecule Name AGN-PC-07Q1FA
IUPAC Name methyl 4-[(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)methyl]benzoate
Synonyms SureCN2060123;CHEBI:721172;methyl 4-[(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)methyl]benzoate
InChi InChI=1S/C18H21N5O4/c1-3-4-9-27-17-21-14(19)13-15(22-17)23(18(25)20-13)10-11-5-7-12(8-6-11)16(24)26-2/h5-8H,3-4,9-10H2,1-2H3,(H,20,25)(H2,19,21,22)
Formula C18H21N5O4 Molecular Weight 371.39
Cross Link CHEMBL1090529

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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