General Information of the Compound
| Compound ID |
CP0563866
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9067935, 57
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H19F6N3O3S
|
||||||||||||||||||
| Molecular Weight |
543.489
|
||||||||||||||||||
| Canonical SMILES |
CCc1c(nc2c(cccn12)C(F)(F)F)N(Cc1ccc(OC(F)(F)F)cc1)S(=O)(=O)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H19F6N3O3S/c1-2-20-22(31-21-19(23(25,26)27)9-6-14-32(20)21)33(37(34,35)18-7-4-3-5-8-18)15-16-10-12-17(13-11-16)36-24(28,29)30/h3-14H,2,15H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
KWTHJHOXXWYMBK-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