General Information of the Compound
| Compound ID |
CP0371731
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(2-chlorophenyl)-3-(4-chlorophenyl)-6-cyclohexyl-2H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H20Cl2N4O
|
||||||||||||||||||
| Molecular Weight |
439.346
|
||||||||||||||||||
| Canonical SMILES |
Clc1ccc(cc1)-c1n(nc2c1ncn(C1CCCCC1)c2=O)-c1ccccc1Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H20Cl2N4O/c24-16-12-10-15(11-13-16)22-20-21(27-29(22)19-9-5-4-8-18(19)25)23(30)28(14-26-20)17-6-2-1-3-7-17/h4-5,8-14,17H,1-3,6-7H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
HUYRDFAANWLWPF-UHFFFAOYSA-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