General Information of the Compound
| Compound ID |
CP0880337
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(piperidin-2-ylmethyl)-3-(pyridin-3-yl)imidazolidin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H20N4O
|
||||||||||||||||||
| Molecular Weight |
260.341
|
||||||||||||||||||
| Canonical SMILES |
O=C1N(CC2CCCCN2)CCN1c1cccnc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H20N4O/c19-14-17(11-12-4-1-2-7-16-12)8-9-18(14)13-5-3-6-15-10-13/h3,5-6,10,12,16H,1-2,4,7-9,11H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
GDBWCGSXGHDTJU-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: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor