General Information of the Compound
Compound ID
CP0520275
Compound Name
N-(3-chloro-4-hydroxyphenyl)-4-phenylbenzenesulfonamide
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Structure
Formula
C18H14ClNO3S
Molecular Weight
359.834
Canonical SMILES
Oc1ccc(NS(=O)(=O)c2ccc(cc2)-c2ccccc2)cc1Cl
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InChI
InChI=1S/C18H14ClNO3S/c19-17-12-15(8-11-18(17)21)20-24(22,23)16-9-6-14(7-10-16)13-4-2-1-3-5-13/h1-12,20-21H
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InChIKey
PAIKZAGYNQBCPL-UHFFFAOYSA-N
Physicochemical Property
logP
4.5134
Rotatable Bonds
4
Heavy Atom Count
24
Polar Areas
66.4
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Complexity
24

"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).

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PubChem ID
CID: 118724174
ChEMBL ID
CHEMBL3360261
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
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