Molecular Details
DICL_CP_0376660
- N-[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl]-4-methylbenzenesulfonamide
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0376660
PubChem CID
Molecular Formula
C23H21NO4S Molecular Weight
407.491 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
GMFIEHDHMSRPRZ-FRKPEAEDSA-N
InChI
InChI=1S/C23H21NO4S/c1-17-3-14-22(15-4-17)29(26,27)24-20-10-8-19(9-11-20)23(25)16-7-18-5-12-21(28-2)...
IUPAC Name
N-[4-[(E)-3-(4-methoxyphenyl)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
29 31 0 0 0 0 0 0 0 0999 V2000
-9.2923 -3.3025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.7970 -3.4219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.9460 -2...
Experimental Data
Activity Data
Target Ion Channel
Potassium channel subfamily K member 10
Uniprot Accession Number
Function
Antagonist
Species
Rattus norvegicus (Rat)
IC50
IC50: 100000 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
29
Rotatable Bonds
7
logP
4.7005
Complexity
114.788
TPSA (Ų)
72.47
H-Bond Donors
1
H-Bond Acceptors
4
Ring Count
3