Molecular Details
DICL_CP_0306940
- thiocyanate
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0306940
PubChem CID
Molecular Formula
CNS- Molecular Weight
58.085 g/mol
Synonyms/Alias
[thiocyanate; Thiocyanate ion; 302-04-5; Rhodanide; Thiocyanate ion (1-); Rhodanid; Thiocyanate anion; 71048-69-6; O748SU14OM; Weedazol tl; hydrogen thiocyanate; Thallium thiocyanate; Ammonium sulfocy...
InChI Key
ZMZDMBWJUHKJPS-UHFFFAOYSA-M
InChI
InChI=1S/CHNS/c2-1-3/h3H/p-1
IUPAC Name
thiocyanate
CAS Number
6317-18-6
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
-0.2051 0.3802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3556 0.5039 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1.5608 0.190...
Experimental Data
Activity Data
Target Ion Channel
Glutamate receptor 1
Uniprot Accession Number
Function
Blocker
Species
Rattus norvegicus (Rat)
IC50
IC50: 1100000 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
18 °C
Test Method
Patch-clamping
Test Species
Not specified
Binding Information
Binding Site
Not specified
Binding Site Residue
Not specified
Disease Information
Related Disease
Not specified
References
Computed Properties
Heavy Atom Count
3
Rotatable Bonds
0
logP
0.0144
Complexity
12.978
TPSA (Ų)
23.79
H-Bond Donors
0
H-Bond Acceptors
2
Ring Count
0