General Information of the Compound
| Compound ID |
CP0566324
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9434711, 324
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H13BrClFN2O2S2
|
||||||||||||||||||
| Molecular Weight |
511.825
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc(Cl)cc1CN(c1sc2ccccc2c1Br)S(=O)(=O)c1cccnc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H13BrClFN2O2S2/c21-19-16-5-1-2-6-18(16)28-20(19)25(12-13-10-14(22)7-8-17(13)23)29(26,27)15-4-3-9-24-11-15/h1-11H,12H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
UXOXPTIGUCPMDC-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