General Information of the Compound
Compound ID
CP0524550
Compound Name
3-{7-phenylimidazo[1,2-a]pyridin-3-yl}pyridine
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Structure
Formula
C18H13N3
Molecular Weight
271.323
Canonical SMILES
c1nc2cc(ccn2c1-c1cccnc1)-c1ccccc1
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InChI
InChI=1S/C18H13N3/c1-2-5-14(6-3-1)15-8-10-21-17(13-20-18(21)11-15)16-7-4-9-19-12-16/h1-13H
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InChIKey
ATOGBWDJZRWYDX-UHFFFAOYSA-N
Physicochemical Property
logP
4.0633
Rotatable Bonds
2
Heavy Atom Count
21
Polar Areas
30.19
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Complexity
21

"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: 5329341
SID: 15442060
ChEMBL ID
CHEMBL172292
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: PT00864, Vascular endothelial growth factor receptor 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 930 nM
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