Molecular Details
DICL_CP_0368253
- N-[4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]-4-methylbenzenesulfonamide
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0368253
PubChem CID
Molecular Formula
C22H19NO4S Molecular Weight
393.464 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
KDODYFOOJCIHGK-GIDUJCDVSA-N
InChI
InChI=1S/C22H19NO4S/c1-16-2-13-21(14-3-16)28(26,27)23-19-9-7-18(8-10-19)22(25)15-6-17-4-11-20(24)12-...
IUPAC Name
N-[4-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]phenyl]-4-methylbenzenesulfonamide
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
28 30 0 0 0 0 0 0 0 0999 V2000
9.4805 -1.6255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1561 -0.9213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8840 -1...
Experimental Data
Activity Data
Target Ion Channel
Potassium channel subfamily K member 10
Uniprot Accession Number
Function
Antagonist
Species
Rattus norvegicus (Rat)
IC50
IC50: 62000 nM
EC50
N/A (Not available)
Ki
N/A (Not available)
Kd
N/A (Not available)
Inhibition
N/A (Not available)
Experimental Conditions
pH
pH 7.4
Holding Potential
60 mV mV
Temperature
Room Temperature
Test Method
Patch-clamping
Test Species
HEK-293 cell
Binding Information
Binding Site
Not specified
Binding Site Residue
Not specified
Disease Information
Related Disease
Not specified
References
Computed Properties
Heavy Atom Count
28
Rotatable Bonds
6
logP
4.3975
Complexity
109.9008
TPSA (Ų)
83.47
H-Bond Donors
2
H-Bond Acceptors
4
Ring Count
3