General Information of the Compound
| Compound ID |
CP0488569
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9434711, 153
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H16BrF2NO2S2
|
||||||||||||||||||
| Molecular Weight |
460.365
|
||||||||||||||||||
| Canonical SMILES |
CCCS(=O)(=O)N(Cc1ccc(F)c(F)c1)c1sc2ccccc2c1Br
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H16BrF2NO2S2/c1-2-9-26(23,24)22(11-12-7-8-14(20)15(21)10-12)18-17(19)13-5-3-4-6-16(13)25-18/h3-8,10H,2,9,11H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
OMXCDIMXYDEJES-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