Basic Molecular Information

Basic Information

DICL ID
DICL_CP_0326391
PubChem CID
Molecular Formula
C17H17N3O2
Molecular Weight
295.342 g/mol
Synonyms/Alias
[PJ34; 344458-19-1; pj-34; N~2~N~2~-DIMETHYL-N~1~-(6-OXO-56-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE; 2-(dimethylamino)-N-(6-oxo-5H-phenanthridin-2-yl)acetamide; 2-(dimethylamino)-N-(6-oxo-56-dihydrophen...
InChI Key
UYJZZVDLGDDTCL-UHFFFAOYSA-N
InChI
InChI=1S/C17H17N3O2/c1-20(2)10-16(21)18-11-7-8-15-14(9-11)12-5-3-4-6-13(12)17(22)19-15/h3-9H,10H2,1-...
IUPAC Name
2-(dimethylamino)-N-(6-oxo-5H-phenanthridin-2-yl)acetamide
CAS Number
344458-19-1

Structure Information

Chemical Structure Visualization

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

39 41 0 0 0 0 0 0 0 0999 V2000
5.6709 -0.1837 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5065 0.1276 0.5240 N 0 0 0 0 0 0 0 0 0 0 0 0
4.8310 1.258...

Experimental Data

Activity Data

Target Ion Channel
Transient receptor potential cation channel subfamily M member 2
Uniprot Accession Number
Function
Inhibitor
Species
Homo sapiens (Human)
IC50
IC50: 25 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 7.2
Holding Potential
−100 to 100 mV mV
Temperature
21−25 °C
Test Method
Patch-clamping
Test Species
HEK293 cell (Homo sapiens embryonic kidney 293 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
22
Rotatable Bonds
3
logP
2.1814
Complexity
89.2584
TPSA (Ų)
65.2
H-Bond Donors
2
H-Bond Acceptors
3
Ring Count
3
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