Basic Molecular Information

Basic Information

DICL ID
DICL_CP_0315489
PubChem CID
Molecular Formula
C14H22N2O
Molecular Weight
234.343 g/mol
Synonyms/Alias
[lidocaine; 137-58-6; Lignocaine; Xylocaine; 2-(Diethylamino)-N-(2;6-dimethylphenyl)acetamide; Lidoderm; Duncaine; Esracaine; Xylestesin; Alphacaine; Cappicaine; Gravocain; Leostesin; Maricaine; Solar...
InChI Key
NNJVILVZKWQKPM-UHFFFAOYSA-N
InChI
InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)
IUPAC Name
2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide
CAS Number
137-58-6

Structure Information

Chemical Structure Visualization

SMILES Notation
2D Molecular Drawing
Carbon (C)
Hydrogen (H)
Oxygen (O)
Nitrogen (N)
Sulfur (S)
SDF

39 39 0 0 0 0 0 0 0 0999 V2000
4.1099 -2.1924 -0.8568 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8425 -0.8688 -0.1461 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4572 -0.417...

Experimental Data

Activity Data

Target Ion Channel
Sodium channel protein type 3 subunit alpha
Uniprot Accession Number
Function
Activator
Species
Homo sapiens (Human)
IC50
IC50: 10500 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
−100 mV mV
Temperature
Not mention
Test Method
Patch-clamping
Test Species
T175 cell

Binding Information

Binding Site
Not specified
Binding Site Residue
Not specified

Disease Information

Related Disease
Not specified

References

URL
N/A (Not available)
PMID
Patent
N/A (Not available)

Computed Properties

Heavy Atom Count
17
Rotatable Bonds
5
logP
2.5837
Complexity
72.3337
TPSA (Ų)
32.34
H-Bond Donors
1
H-Bond Acceptors
2
Ring Count
1
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