General Information of the Compound
| Compound ID |
CP0499678
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]naphthalene-2-sulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H24N2O2S
|
||||||||||||||||||
| Molecular Weight |
380.513
|
||||||||||||||||||
| Canonical SMILES |
O=S(=O)(NCCCN1CCc2ccccc2C1)c1ccc2ccccc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H24N2O2S/c25-27(26,22-11-10-18-6-1-3-8-20(18)16-22)23-13-5-14-24-15-12-19-7-2-4-9-21(19)17-24/h1-4,6-11,16,23H,5,12-15,17H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
MAKNDTQMZPEUKX-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