1-(5-chloro-2-hydroxyphenyl)-3-[3-(trifluoromethyl)phenyl]urea
AlkaPlorer ID: AK264608
Synonym: None
IUPAC Name: 1-(5-chloro-2-hydroxyphenyl)-3-[3-(trifluoromethyl)phenyl]urea
Structure
SMILES: O=C(NC1=CC=CC(C(F)(F)F)=C1)NC1=CC(Cl)=CC=C1O
InChI: InChI=1S/C14H10ClF3N2O2/c15-9-4-5-12(21)11(7-9)20-13(22)19-10-3-1-2-8(6-10)14(16,17)18/h1-7,21H,(H2,19,20,22)
InChIKey: KRHJDJMOIKRPNN-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 330.693
TPSA？: 61.36
MolLogP？: 4.708400000000002
Number of H-Donors: 3
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Calcium-activated potassium channel subunit alpha-1 | Control current | 124.0 | % | 10.1016/s0960-894x(03)00156-2 |
| Homo sapiens | Cell division cycle 2-like protein kinase 6 | Ki | 19952.62 | nM | None |
| Homo sapiens | Glutamate receptor ionotropic kainate 1 | IC50 | 30000.0 | nM | 10.1021/jm030638w |
| Homo sapiens | Nerve growth factor receptor Trk-A | Ki | 10000.0 | nM | None |
| None | No relevant target | pKa | 9.3 | None | 10.1016/s0960-894x(03)00156-2 |