General Information of the Compound
| Compound ID |
CP0956150
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
SID24383997
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H22N2O4S
|
||||||||||||||||||
| Molecular Weight |
434.517
|
||||||||||||||||||
| Canonical SMILES |
CCN1C(=O)c2ccccc2[S+]([O-])c2ccc(C(=O)NCc3ccccc3OC)cc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H22N2O4S/c1-3-26-19-14-16(23(27)25-15-17-8-4-6-10-20(17)30-2)12-13-22(19)31(29)21-11-7-5-9-18(21)24(26)28/h4-14H,3,15H2,1-2H3,(H,25,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JBQOQPITCJDIJI-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