Basic Molecular Information

Basic Information

DICL ID
DICL_CP_0306929
PubChem CID
Molecular Formula
C2H6O
Molecular Weight
46.069 g/mol
Synonyms/Alias
[ethanol; ethyl alcohol; alcohol; 64-17-5; grain alcohol; Methylcarbinol; Ethyl hydrate; Tecsol; Ethyl hydroxide; Algrain; Anhydrol; EtOH; Hydroxyethane; Alkohol; Jaysol S; Potato alcohol; 1-Hydroxyet...
InChI Key
LFQSCWFLJHTTHZ-UHFFFAOYSA-N
InChI
InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
IUPAC Name
ethanol
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

3 2 0 0 0 0 0 0 0 0999 V2000
-1.2990 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2990 -0...

Experimental Data

Activity Data

Target Ion Channel
P2X purinoceptor 4
Uniprot Accession Number
Function
Inhibitor
Species
Rattus norvegicus (Rat)
IC50
IC50: 58000000 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
−70 mV mV
Temperature
Room Temperature
Test Method
Patch-clamping
Test Species
Xenopus laevis oocyte

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
3
Rotatable Bonds
0
logP
-0.0014
Complexity
12.7598
TPSA (Ų)
20.23
H-Bond Donors
1
H-Bond Acceptors
1
Ring Count
0
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