General Information of the Compound
Compound ID
CP0418670
Compound Name
N-(4-hydroxynaphthalen-1-yl)-4-phenylbenzenesulfonamide
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Structure
Formula
C22H17NO3S
Molecular Weight
375.449
Canonical SMILES
Oc1ccc(NS(=O)(=O)c2ccc(cc2)-c2ccccc2)c2ccccc12
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InChI
InChI=1S/C22H17NO3S/c24-22-15-14-21(19-8-4-5-9-20(19)22)23-27(25,26)18-12-10-17(11-13-18)16-6-2-1-3-7-16/h1-15,23-24H
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InChIKey
ZLXLGHCZUBGOCL-UHFFFAOYSA-N
Physicochemical Property
logP
5.0132
Rotatable Bonds
4
Heavy Atom Count
27
Polar Areas
66.4
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Complexity
27

"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: 118724176
ChEMBL ID
CHEMBL3360263
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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