Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

1148070 - Overview - Compound Synopsis

Synonyms
1O1
Molecular Formula
C21H17NO7S
InChI
InChI=1S/C21H17NO7S/c1-13-2-9-17(10-3-13)30(27,28)22-19-11-8-16(12-18(19)21(25)26)29-15-6-4-14(5-7-15)20(23)24/h2-12,22H,1H3,(H,23,24)(H,25,26)
Smiles
Cc1ccc(S(=O)(=O)Nc2ccc(Oc3ccc(C(=O)O)cc3)cc2C(=O)O)cc1
Cross References
UniChem68940314
canSAR1148070
PDBe (Protein Data Bank Europe)1O1
ChEMBLCHEMBL3092018
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 427.0725728843.984523847No


Compounds with the same scaffold


Image of compound ID: 1148070
Murko Scaffold Family: 4095 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12