General Information of the Compound
Compound ID
CP0569190
Compound Name
2-(2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine
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Structure
Formula
C15H15N3O2
Molecular Weight
269.304
Canonical SMILES
COc1ccc(-c2nc3ccccn3c2N)c(OC)c1
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InChI
InChI=1S/C15H15N3O2/c1-19-10-6-7-11(12(9-10)20-2)14-15(16)18-8-4-3-5-13(18)17-14/h3-9H,16H2,1-2H3
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InChIKey
NICJGIQLCSNIEP-UHFFFAOYSA-N
Physicochemical Property
logP
2.6007
Rotatable Bonds
3
Heavy Atom Count
20
Polar Areas
61.78
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Complexity
20

"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: 63616904
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: PT02160, Toll-like receptor 7
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000686 HEK-Blue hTLR7 Homo sapiens (Human)  1
1
IC50 > 30000 nM
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