General Information of the Compound
Compound ID
CP0563719
Compound Name
6-chloro-4-phenyl-1H-indazole
    Show/Hide
Structure
Formula
C13H9ClN2
Molecular Weight
228.682
Canonical SMILES
Clc1cc(-c2ccccc2)c2cn[nH]c2c1
    Show/Hide
InChI
InChI=1S/C13H9ClN2/c14-10-6-11(9-4-2-1-3-5-9)12-8-15-16-13(12)7-10/h1-8H,(H,15,16)
    Show/Hide
InChIKey
QHDWHCBIHPDKKB-UHFFFAOYSA-N
Physicochemical Property
logP
3.8833
Rotatable Bonds
1
Heavy Atom Count
16
Polar Areas
28.68
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
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: 127047863
ChEMBL ID
CHEMBL3799496
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: PT00973, Methionine aminopeptidase 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 79 nM
   TI
   LI
   LO
   TS