General Information of the Compound
| Compound ID |
CP0560894
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9422235, 20
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H23F3N2O5S
|
||||||||||||||||||
| Molecular Weight |
448.463
|
||||||||||||||||||
| Canonical SMILES |
COCCCNS(=O)(=O)c1ccc(Nc2cc(OC)cc(OC)c2)cc1C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H23F3N2O5S/c1-27-8-4-7-23-30(25,26)18-6-5-13(11-17(18)19(20,21)22)24-14-9-15(28-2)12-16(10-14)29-3/h5-6,9-12,23-24H,4,7-8H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
QIVAUKQYFWWWPZ-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