General Information of the Compound
Compound ID
CP0082614
Compound Name
5-phenyl-1H-pyrazolo[3,4-c]pyridin-3-amine
    Show/Hide
Structure
Formula
C12H10N4
Molecular Weight
210.24
Canonical SMILES
Nc1n[nH]c2cnc(cc12)-c1ccccc1
    Show/Hide
InChI
InChI=1S/C12H10N4/c13-12-9-6-10(8-4-2-1-3-5-8)14-7-11(9)15-16-12/h1-7H,(H3,13,15,16)
    Show/Hide
InChIKey
LZRFNYHUQSRPCO-UHFFFAOYSA-N
Physicochemical Property
logP
2.2071
Rotatable Bonds
1
Heavy Atom Count
16
Polar Areas
67.59
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Complexity
16

"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: 6539529
ChEMBL ID
CHEMBL259925
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: PT00704, Venus kinase receptor 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
Kd = 47000 nM
   TI
   LI
   LO
   TS