CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00454919" in compound.

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CFAM Mol ID CFAMM00454919
Family CFFBM20200 Targeted effector protein and Tyrosine-protein phosphatase non-receptor type 1 ligand AGN-PC-080DLR family
Superfamily CFSBM7846 Cruzipain and Beta-lactamase Binder Superfamily 15
Class CFCBM1581 Class 4631
External ID CHEMBL1240793 External Source CHEMBL
PubChem CID 46938546 Functional Category Bioactive
Molecule Name AGN-PC-080DLU
IUPAC Name 2-[4-[[3-[[4-(4-methylsulfanylphenoxy)phenyl]carbamoyl]-4-[(4-oxalophenoxy)methyl]phenyl]methoxy]phenyl]-2-oxoacetic acid
Synonyms CHEBI:800005;2-[4-[[3-[[4-(4-methylsulfanylphenoxy)phenyl]carbamoyl]-4-[(4-oxalophenoxy)methyl]phenyl]methoxy]phenyl]-2-oxoacetic acid
InChi InChI=1S/C38H29NO10S/c1-50-32-18-16-31(17-19-32)49-30-14-8-27(9-15-30)39-36(42)33-20-23(21-47-28-10-4-24(5-11-28)34(40)37(43)44)2-3-26(33)22-48-29-12-6-25(7-13-29)35(41)38(45)46/h2-20H,21-22H2,1H3,(H,39,42)(H,43,44)(H,45,46)
Formula C38H29NO10S Molecular Weight 691.70
Cross Link CHEMBL1240793

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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