General Information of the Compound
| Compound ID |
CP0405079
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-(4-chlorophenyl)-1-[1-(2-chlorophenyl)sulfonyl-4-methylpiperidin-4-yl]piperidin-4-ol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H28Cl2N2O3S
|
||||||||||||||||||
| Molecular Weight |
483.461
|
||||||||||||||||||
| Canonical SMILES |
CC1(CCN(CC1)S(=O)(=O)c1ccccc1Cl)N1CCC(O)(CC1)c1ccc(Cl)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H28Cl2N2O3S/c1-22(26-14-12-23(28,13-15-26)18-6-8-19(24)9-7-18)10-16-27(17-11-22)31(29,30)21-5-3-2-4-20(21)25/h2-9,28H,10-17H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
WRSQDCNPGOEXAQ-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