General Information of the Compound
Compound ID
CP0554351
Compound Name
N-(1-methylindol-5-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine
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Structure
Formula
C15H13N5
Molecular Weight
263.304
Canonical SMILES
Cn1ccc2cc(Nc3n[nH]c4cccnc34)ccc12
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InChI
InChI=1S/C15H13N5/c1-20-8-6-10-9-11(4-5-13(10)20)17-15-14-12(18-19-15)3-2-7-16-14/h2-9H,1H3,(H2,17,18,19)
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InChIKey
KFHITONAJCKILY-UHFFFAOYSA-N
Physicochemical Property
logP
3.1932
Rotatable Bonds
2
Heavy Atom Count
20
Polar Areas
58.53
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
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: 53374105
SID: 125295807
ChEMBL ID
CHEMBL4243164
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: PT02199, Metabotropic glutamate receptor 4
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
EC50 = 3590 nM
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