General Information of the Compound
Compound ID
CP0857336
Compound Name
2,3-Bis(4-methoxyphenyl)-6-(morpholinosulfonyl)quinoxaline
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Structure
Formula
C26H25N3O5S
Molecular Weight
491.569
Canonical SMILES
COc1ccc(-c2nc3ccc(S(=O)(=O)N4CCOCC4)cc3nc2-c2ccc(OC)cc2)cc1
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InChI
InChI=1S/C26H25N3O5S/c1-32-20-7-3-18(4-8-20)25-26(19-5-9-21(33-2)10-6-19)28-24-17-22(11-12-23(24)27-25)35(30,31)29-13-15-34-16-14-29/h3-12,17H,13-16H2,1-2H3
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InChIKey
SDXKYWITACIFPG-UHFFFAOYSA-N
Physicochemical Property
logP
4.0019
Rotatable Bonds
6
Heavy Atom Count
35
Polar Areas
90.85
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
7
Complexity
35

"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: 70654224
ChEMBL ID
CHEMBL3719202
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: PT01628, PAS domain-containing serine/threonine-protein kinase
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 <= 10000 nM
   TI
   LI
   LO
   TS