General Information of the Compound
| Compound ID |
CP0553076
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(2R)-2-hydroxy-3-(2-methylpiperidin-1-yl)propyl]naphthalene-1-sulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H26N2O3S
|
||||||||||||||||||
| Molecular Weight |
362.495
|
||||||||||||||||||
| Canonical SMILES |
CC1CCCCN1C[C@@H](O)CNS(=O)(=O)c1cccc2ccccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H26N2O3S/c1-15-7-4-5-12-21(15)14-17(22)13-20-25(23,24)19-11-6-9-16-8-2-3-10-18(16)19/h2-3,6,8-11,15,17,20,22H,4-5,7,12-14H2,1H3/t15?,17-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
IFCYHVCTAATODB-LWKPJOBUSA-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