General Information of the Compound
Compound ID
CP0860761
Compound Name
4-(3-(morpholinomethyl)-6-phenylimidazo[1,2-a]pyridin-2-yl)benzamide
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Structure
Formula
C25H24N4O2
Molecular Weight
412.493
Canonical SMILES
NC(=O)c1ccc(-c2nc3ccc(-c4ccccc4)cn3c2CN2CCOCC2)cc1
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InChI
InChI=1S/C25H24N4O2/c26-25(30)20-8-6-19(7-9-20)24-22(17-28-12-14-31-15-13-28)29-16-21(10-11-23(29)27-24)18-4-2-1-3-5-18/h1-11,16H,12-15,17H2,(H2,26,30)
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InChIKey
ALJDCZZWSNEHJZ-UHFFFAOYSA-N
Physicochemical Property
logP
3.5994
Rotatable Bonds
5
Heavy Atom Count
31
Polar Areas
72.86
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Complexity
31

"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: 121309664
ChEMBL ID
CHEMBL4290530
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 > 100000 nM
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