General Information of the Compound
| Compound ID |
CP0381350
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[1-(2-phenoxyethyl)piperidin-4-yl]thiophene-2-sulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H22N2O3S2
|
||||||||||||||||||
| Molecular Weight |
366.508
|
||||||||||||||||||
| Canonical SMILES |
O=S(=O)(NC1CCN(CCOc2ccccc2)CC1)c1cccs1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H22N2O3S2/c20-24(21,17-7-4-14-23-17)18-15-8-10-19(11-9-15)12-13-22-16-5-2-1-3-6-16/h1-7,14-15,18H,8-13H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
KHFRVSBPNUGGOX-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT00941, 5-hydroxytryptamine receptor 7
Protein ID: PT01005, D(2) dopamine receptor