General Information of the Compound
| Compound ID |
CP0429381
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(5Z)-5-[[3-[(4-chlorophenyl)methoxy]phenyl]methylidene]-3-methyl-2-methylsulfanylimidazol-4-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H17ClN2O2S
|
||||||||||||||||||
| Molecular Weight |
372.877
|
||||||||||||||||||
| Canonical SMILES |
CSC1=N\C(=C/c2cccc(OCc3ccc(Cl)cc3)c2)C(=O)N1C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H17ClN2O2S/c1-22-18(23)17(21-19(22)25-2)11-14-4-3-5-16(10-14)24-12-13-6-8-15(20)9-7-13/h3-11H,12H2,1-2H3/b17-11-
Show/Hide
|
||||||||||||||||||
| InChIKey |
QDRIEIXVKFKNBJ-BOPFTXTBSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2
Protein ID: PT05453, G-protein coupled receptor 55
Protein ID: PT06110, N-arachidonyl glycine receptor