General Information of the Compound
| Compound ID |
CP0430724
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(Dimethylamino)-N-[5-[4-(2-methoxyphenyl)piperazin-1-yl]pentyl]-1-naphthalenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H38N4O3S
|
||||||||||||||||||
| Molecular Weight |
510.704
|
||||||||||||||||||
| Canonical SMILES |
COc1ccccc1N1CCN(CCCCCNS(=O)(=O)c2cccc3c(cccc23)N(C)C)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H38N4O3S/c1-30(2)25-14-9-12-24-23(25)11-10-16-28(24)36(33,34)29-17-7-4-8-18-31-19-21-32(22-20-31)26-13-5-6-15-27(26)35-3/h5-6,9-16,29H,4,7-8,17-22H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
QHWRIZRQECTZRR-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