General Information of the Compound
| Compound ID |
CP0488494
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[3-[methyl-[3-(4-phenylpiperazin-1-yl)propyl]amino]phenyl]methanesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H30N4O2S
|
||||||||||||||||||
| Molecular Weight |
402.564
|
||||||||||||||||||
| Canonical SMILES |
CN(CCCN1CCN(CC1)c1ccccc1)c1cccc(NS(C)(=O)=O)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H30N4O2S/c1-23(21-11-6-8-19(18-21)22-28(2,26)27)12-7-13-24-14-16-25(17-15-24)20-9-4-3-5-10-20/h3-6,8-11,18,22H,7,12-17H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
FCESLTMWMZZGNC-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