General Information of the Compound
Compound ID
CP0036294
Compound Name
4-[2-(4-Chloro-phenyl)-5-(3-phenoxy-phenyl)-3H-imidazol-4-yl]-pyridine
    Show/Hide
Structure
Formula
C26H18ClN3O
Molecular Weight
423.903
Canonical SMILES
Clc1ccc(cc1)-c1nc(c([nH]1)-c1cccc(Oc2ccccc2)c1)-c1ccncc1
    Show/Hide
InChI
InChI=1S/C26H18ClN3O/c27-21-11-9-19(10-12-21)26-29-24(18-13-15-28-16-14-18)25(30-26)20-5-4-8-23(17-20)31-22-6-2-1-3-7-22/h1-17H,(H,29,30)
    Show/Hide
InChIKey
KWBJZWKTXONOQI-UHFFFAOYSA-N
Physicochemical Property
logP
7.2514
Rotatable Bonds
5
Heavy Atom Count
31
Polar Areas
50.8
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
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).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 44319495
ChEMBL ID
CHEMBL85807
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: PT01473, Glucagon receptor
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 = 220.29 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 13 nM
2 IC50 = 150 nM