General Information of the Compound
Compound ID
CP0128203
Compound Name
1H-Indazol-5-ylamine
    Show/Hide
Structure
Formula
C7H7N3
Molecular Weight
133.154
Canonical SMILES
Nc1ccc2[nH]ncc2c1
    Show/Hide
InChI
InChI=1S/C7H7N3/c8-6-1-2-7-5(3-6)4-9-10-7/h1-4H,8H2,(H,9,10)
    Show/Hide
InChIKey
XBTOSRUBOXQWBO-UHFFFAOYSA-N
CAS
19335-11-6
Physicochemical Property
logP
1.1451
Rotatable Bonds
0
Heavy Atom Count
10
Polar Areas
54.7
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Complexity
10

"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: 88012
SID: 16225987
ChEMBL ID
CHEMBL17551
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: PT06109, Geminin
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000015 SW480 Homo sapiens (Human)  1
1
Potency ~ 1000 nM
   TI
   LI
   LO
   TS
Protein ID: PT01184, Rho-associated protein kinase 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 181300 nM
   TI
   LI
   LO
   TS