Molecular Details
DICL_CP_0359501
- 4-methyl-N-[4-[(E)-3-phenylprop-2-enoyl]phenyl]benzenesulfonamide
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0359501
PubChem CID
Molecular Formula
C22H19NO3S Molecular Weight
377.465 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
MFOIDMXDKSXGLH-CXUHLZMHSA-N
InChI
InChI=1S/C22H19NO3S/c1-17-7-14-21(15-8-17)27(25,26)23-20-12-10-19(11-13-20)22(24)16-9-18-5-3-2-4-6-1...
IUPAC Name
4-methyl-N-[4-[(E)-3-phenylprop-2-enoyl]phenyl]benzenesulfonamide
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
27 29 0 0 0 0 0 0 0 0999 V2000
9.0735 -1.7478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7629 -1.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4757 -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: >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
27
Rotatable Bonds
6
logP
4.6919
Complexity
108.236
TPSA (Ų)
63.24
H-Bond Donors
1
H-Bond Acceptors
3
Ring Count
3