General Information of the Compound
| Compound ID |
CP0490205
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-{2-[3-(2-Phenyl-1H-indol-3-yl)-piperidin-1-yl]-ethyl}-imidazolidin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H28N4O
|
||||||||||||||||||
| Molecular Weight |
388.515
|
||||||||||||||||||
| Canonical SMILES |
O=C1NCCN1CCN1CCCC(C1)c1c([nH]c2ccccc12)-c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H28N4O/c29-24-25-12-14-28(24)16-15-27-13-6-9-19(17-27)22-20-10-4-5-11-21(20)26-23(22)18-7-2-1-3-8-18/h1-5,7-8,10-11,19,26H,6,9,12-17H2,(H,25,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XTOXNGQJKCDLHX-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C
Protein ID: PT01005, D(2) dopamine receptor