General Information of the Compound
| Compound ID |
CP0396299
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2Z)-2-[[3-[4-(4-chlorophenoxy)butoxy]phenyl]methylidene]-6,7-dihydro-5H-imidazo[2,1-b][1,3]thiazin-3-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H23ClN2O3S
|
||||||||||||||||||
| Molecular Weight |
442.968
|
||||||||||||||||||
| Canonical SMILES |
Clc1ccc(OCCCCOc2cccc(\C=C3/N=C4SCCCN4C3=O)c2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H23ClN2O3S/c24-18-7-9-19(10-8-18)28-12-1-2-13-29-20-6-3-5-17(15-20)16-21-22(27)26-11-4-14-30-23(26)25-21/h3,5-10,15-16H,1-2,4,11-14H2/b21-16-
Show/Hide
|
||||||||||||||||||
| InChIKey |
PFQVGYDPXWSPNS-PGMHBOJBSA-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