General Information of the Compound
Compound ID
CP0438675
Compound Name
[3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl]-phenylmethanol
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Structure
Formula
C26H19ClN2O
Molecular Weight
410.904
Canonical SMILES
OC(c1ccccc1)c1cccc(c1)-c1ccc2nc(cn2c1)-c1ccc(Cl)cc1
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InChI
InChI=1S/C26H19ClN2O/c27-23-12-9-18(10-13-23)24-17-29-16-22(11-14-25(29)28-24)20-7-4-8-21(15-20)26(30)19-5-2-1-3-6-19/h1-17,26,30H
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InChIKey
FLRVREFLPLXHCL-UHFFFAOYSA-N
Physicochemical Property
logP
6.4034
Rotatable Bonds
4
Heavy Atom Count
30
Polar Areas
37.53
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
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: 24856090
SID: 50085346
ChEMBL ID
CHEMBL4547651
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: PT05155, Nuclear receptor subfamily 4 group A member 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
EC50 > 3000 nM
   TI
   LI
   LO
   TS