Molecular Details
DICL_CP_0320747
- N-(2-hydroxy-5-methylphenyl)-2-(2-methoxyphenyl)acetamide
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0320747
PubChem CID
Molecular Formula
C16H17NO3 Molecular Weight
271.316 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
WROVTGMNGSUPMR-UHFFFAOYSA-N
InChI
InChI=1S/C16H17NO3/c1-11-7-8-14(18)13(9-11)17-16(19)10-12-5-3-4-6-15(12)20-2/h3-9,18H,10H2,1-2H3,(H,...
IUPAC Name
N-(2-hydroxy-5-methylphenyl)-2-(2-methoxyphenyl)acetamide
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
37 38 0 0 0 0 0 0 0 0999 V2000
-2.2352 2.7761 -0.2344 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0543 1.5499 0.4658 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6485 0.329...
Experimental Data
Activity Data
Target Ion Channel
Calcium-activated potassium channel subunit alpha-1
Uniprot Accession Number
Function
Activator
Species
Rattus norvegicus (Rat)
IC50
IC50: 24547.09 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
37 ℃
Test Method
Binding assay
Test Species
Not specified
Binding Information
Binding Site
Not specified
Binding Site Residue
Not specified
Disease Information
Related Disease
Not specified
References
Computed Properties
Heavy Atom Count
20
Rotatable Bonds
4
logP
2.8904
Complexity
78.1715
TPSA (Ų)
58.56
H-Bond Donors
2
H-Bond Acceptors
3
Ring Count
2