Molecular Details
DICL_CP_0317009
- 2-cyclohexyl-N'-(2-methylphenyl)acetohydrazide
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0317009
PubChem CID
Molecular Formula
C15H22N2O Molecular Weight
246.354 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
ZCGFCSJOZIHFKU-UHFFFAOYSA-N
InChI
InChI=1S/C15H22N2O/c1-12-7-5-6-10-14(12)16-17-15(18)11-13-8-3-2-4-9-13/h5-7,10,13,16H,2-4,8-9,11H2,1...
IUPAC Name
2-cyclohexyl-N'-(2-methylphenyl)acetohydrazide
CAS Number
N/A (Not available)
Structure Information
Chemical Structure Visualization
SMILES Notation
2D Molecular Drawing
Carbon (C)
Hydrogen (H)
Oxygen (O)
Nitrogen (N)
Sulfur (S)
SDF
40 41 0 0 0 0 0 0 0 0999 V2000
3.1624 1.6427 1.4443 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7213 0.6113 0.5014 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7872 0.968...
Experimental Data
Activity Data
Target Ion Channel
P2X purinoceptor 7
Uniprot Accession Number
Function
Antagonist
Species
Rattus norvegicus (Rat)
IC50
IC50: 151.36 nM
EC50
N/A (Not available)
Ki
N/A (Not available)
Kd
N/A (Not available)
Inhibition
N/A (Not available)
Experimental Conditions
pH
Not mention
Holding Potential
Not specified
Temperature
4 °C
Test Method
Fluorometric Imaging Plate Reader (FLIPR) Membrane Potential Assay
Test Species
THP-1 cell
Binding Information
Binding Site
Not specified
Binding Site Residue
Not specified
Disease Information
Related Disease
Not specified
References
Computed Properties
Heavy Atom Count
18
Rotatable Bonds
4
logP
3.4085
Complexity
74.1364
TPSA (Ų)
41.13
H-Bond Donors
2
H-Bond Acceptors
2
Ring Count
2