General Information of the Compound
| Compound ID |
CP0516755
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9187424, 232
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H26F6N4O4
|
||||||||||||||||||
| Molecular Weight |
608.539
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(nn1)C(=O)NC1=C(CC(NC1=O)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F)c1ccc(C)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H26F6N4O4/c1-17-4-6-18(7-5-17)21-16-27(29(33,34)35,19-8-10-20(11-9-19)43-15-3-14-28(30,31)32)37-26(41)24(21)36-25(40)22-12-13-23(42-2)39-38-22/h4-13H,3,14-16H2,1-2H3,(H,36,40)(H,37,41)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VGNRZOMFMDBBJS-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