General Information of the Compound
Compound ID
CP0379698
Compound Name
2-hydroxy-5-[(4-phenylphenyl)sulfonylamino]benzoic acid
    Show/Hide
Structure
Formula
C19H15NO5S
Molecular Weight
369.398
Canonical SMILES
OC(=O)c1cc(NS(=O)(=O)c2ccc(cc2)-c2ccccc2)ccc1O
    Show/Hide
InChI
InChI=1S/C19H15NO5S/c21-18-11-8-15(12-17(18)19(22)23)20-26(24,25)16-9-6-14(7-10-16)13-4-2-1-3-5-13/h1-12,20-21H,(H,22,23)
    Show/Hide
InChIKey
ZHUKUTFVXZFATC-UHFFFAOYSA-N
Physicochemical Property
logP
3.5582
Rotatable Bonds
5
Heavy Atom Count
26
Polar Areas
103.7
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
4
Complexity
26

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 118724175
ChEMBL ID
CHEMBL3360262
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT03034, Cytochrome b-c1 complex subunit 7
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000063 Hep-G2 Homo sapiens (Human)  1
1
IC50 > 20000 nM
   TI
   LI
   LO
   TS