General Information of the Compound
Compound ID
CP0468319
Compound Name
1-(2-acetyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-[(4-fluorophenyl)methoxy]pyridin-2-one
    Show/Hide
Structure
Formula
C22H18FN3O3
Molecular Weight
391.402
Canonical SMILES
CC(=O)c1nc2ccc(cn2c1C)-n1ccc(OCc2ccc(F)cc2)cc1=O
    Show/Hide
InChI
InChI=1S/C22H18FN3O3/c1-14-22(15(2)27)24-20-8-7-18(12-26(14)20)25-10-9-19(11-21(25)28)29-13-16-3-5-17(23)6-4-16/h3-12H,13H2,1-2H3
    Show/Hide
InChIKey
OOARKYPMMJPUHX-UHFFFAOYSA-N
Physicochemical Property
logP
3.71432
Rotatable Bonds
5
Heavy Atom Count
29
Polar Areas
65.6
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
Complexity
29

"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).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 89690968
ChEMBL ID
CHEMBL3770750
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: PT01388, Melanin-concentrating hormone receptor 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 > 1000 nM
   TI
   LI
   LO
   TS
Protein ID: PT01027, Melanin-concentrating hormone receptor 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 > 1000 nM
   TI
   LI
   LO
   TS