General Information of the Compound
| Compound ID |
CP0541190
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[3-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]propyl]-4-phenylbenzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H29ClN2O3S
|
||||||||||||||||||
| Molecular Weight |
485.049
|
||||||||||||||||||
| Canonical SMILES |
OC1(CCN(CCCNS(=O)(=O)c2ccc(cc2)-c2ccccc2)CC1)c1ccc(Cl)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H29ClN2O3S/c27-24-11-9-23(10-12-24)26(30)15-19-29(20-16-26)18-4-17-28-33(31,32)25-13-7-22(8-14-25)21-5-2-1-3-6-21/h1-3,5-14,28,30H,4,15-20H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
YHKIFARXBYKNQP-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