General Information of the Compound
| Compound ID |
CP0474527
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9120756, 74
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H14ClF4N3O
|
||||||||||||||||||
| Molecular Weight |
411.786
|
||||||||||||||||||
| Canonical SMILES |
Fc1cccc(CC(=O)NCc2cc(nn2-c2cccc(Cl)c2)C(F)(F)F)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H14ClF4N3O/c20-13-4-2-6-15(9-13)27-16(10-17(26-27)19(22,23)24)11-25-18(28)8-12-3-1-5-14(21)7-12/h1-7,9-10H,8,11H2,(H,25,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FHOABVDHYAEXMO-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