General Information of the Compound
Compound ID
CP0905108
Compound Name
4-((2-(3-methoxyphenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl)methyl)morpholine
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Structure
Formula
C25H25N3O2
Molecular Weight
399.494
Canonical SMILES
COc1cccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCOCC2)c1
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InChI
InChI=1S/C25H25N3O2/c1-29-22-9-5-8-20(16-22)25-23(18-27-12-14-30-15-13-27)28-17-21(10-11-24(28)26-25)19-6-3-2-4-7-19/h2-11,16-17H,12-15,18H2,1H3
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InChIKey
HEVZBNRRBCMZSY-UHFFFAOYSA-N
Physicochemical Property
logP
4.5091
Rotatable Bonds
5
Heavy Atom Count
30
Polar Areas
39
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Complexity
30

"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: 121309662
ChEMBL ID
CHEMBL4292877
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: PT04657, Solute carrier family 2, facilitated glucose transporter member 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 10000 nM
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