General Information of the Compound
Compound ID
CP0203179
Compound Name
6-bromo-1H-indazole
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Synonyms
1788080-23-8
1H-INDAZOLE,6-BROMO-
1H-Indazole, 6-bromo-
6- Bromoindazole
6-Bromo-1H-indazole, 95%
6-Bromo-1H-indazole, 97%
6-Bromo-2H-indazole
6-Bromoindazole
6-broMo-1H indazole
6-bromanyl-1H-indazole
6-bromo-1-H-indazole
6-bromo-1H-indazole
79762-54-2
AC1Q251Y
ACMC-209pi5
ACN-S003161
ACT06505
AMBZ0200
BCP00386
CHEMBL247365
CS-D0757
CTK2H6947
DTXSID80591229
KS-000002SJ
KSC376S4P
MolPort-000-001-819
MolPort-029-084-056
PubChem7831
SCHEMBL5902
WMKDUJVLNZANRN-UHFFFAOYSA-N
ZINC8764137
ZLE0012
zlchem 1237
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Structure
Formula
C7H5BrN2
Molecular Weight
197.035
Canonical SMILES
Brc1ccc2cn[nH]c2c1
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InChI
InChI=1S/C7H5BrN2/c8-6-2-1-5-4-9-10-7(5)3-6/h1-4H,(H,9,10)
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InChIKey
WMKDUJVLNZANRN-UHFFFAOYSA-N
Physicochemical Property
logP
2.3254
Rotatable Bonds
0
Heavy Atom Count
10
Polar Areas
28.68
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
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).

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PubChem ID
CID: 17842471
SID: 103906581
ChEMBL ID
CHEMBL247365
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
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 1100 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( 6-bromo-1H-indazole )
Drug Name 6-bromo-1H-indazole
Target(s)
Nitric-oxide synthase brain (NOS1)
 Target Info 
Inhibitor