General Information of the Compound
| Compound ID |
CP0515447
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9434711, 585
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H14ClF3N2O2S2
|
||||||||||||||||||
| Molecular Weight |
434.892
|
||||||||||||||||||
| Canonical SMILES |
Nc1ccc(cc1)S(=O)(=O)N(CCC(F)(F)F)c1sc2ccccc2c1Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H14ClF3N2O2S2/c18-15-13-3-1-2-4-14(13)26-16(15)23(10-9-17(19,20)21)27(24,25)12-7-5-11(22)6-8-12/h1-8H,9-10,22H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
CTPLYGCPZYVURN-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