Basic Molecular Information

Basic Information

DICL ID
DICL_CP_0325386
PubChem CID
Molecular Formula
C17H17N5
Molecular Weight
291.358 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
YYNRZIFBTOUICE-UHFFFAOYSA-N
InChI
InChI=1S/C17H17N5/c1-2-8-13-12(6-1)7-5-11-15(13)18-16-10-4-3-9-14(16)17-19-21-22-20-17/h3-5,7,9-11,1...
IUPAC Name
N-[2-(2H-tetrazol-5-yl)phenyl]-5,6,7,8-tetrahydronaphthalen-1-amine
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

39 42 0 0 0 0 0 0 0 0999 V2000
4.3505 -1.3240 0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1358 -2.0552 -0.6255 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9886 -1.130...

Experimental Data

Activity Data

Target Ion Channel
Potassium channel subfamily K member 10
Uniprot Accession Number
Function
Activator
Species
Homo sapiens (Human)
IC50
N/A (Not available)
EC50
EC50: 7700 nM
Ki
N/A (Not available)
Kd
N/A (Not available)
Inhibition
N/A (Not available)

Experimental Conditions

pH
not mention
Holding Potential
Not specified
Temperature
Not mention
Test Method
Flux assay (Thallium ion)
Test Species
Not specified

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
22
Rotatable Bonds
3
logP
3.4891
Complexity
85.9804
TPSA (Ų)
66.49
H-Bond Donors
2
H-Bond Acceptors
4
Ring Count
4
New Search