Molecular Details
DICL_CP_0320906
- 2-(2-hydroxyphenyl)-N-(4-nitrophenyl)acetamide
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0320906
PubChem CID
Molecular Formula
C14H12N2O4 Molecular Weight
272.26 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
JKHRTGCSAYLPQR-UHFFFAOYSA-N
InChI
InChI=1S/C14H12N2O4/c17-13-4-2-1-3-10(13)9-14(18)15-11-5-7-12(8-6-11)16(19)20/h1-8,17H,9H2,(H,15,18)
IUPAC Name
2-(2-hydroxyphenyl)-N-(4-nitrophenyl)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
32 33 0 0 0 0 0 0 0 0999 V2000
4.3518 -0.2877 -2.1046 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8363 0.1367 -0.8772 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5583 1.106...
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: 22908.68 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
2.4816
Complexity
73.5369
TPSA (Ų)
92.47
H-Bond Donors
2
H-Bond Acceptors
4
Ring Count
2