General Information of the Compound
| Compound ID |
CP0567629
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9278960, 4-35
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H23FN4O2
|
||||||||||||||||||
| Molecular Weight |
406.461
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)NC1CCN(Cc2ccc3c(cc(nc3c2)C(N)=O)-c2ccc(F)cc2)C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H23FN4O2/c1-14(29)26-18-8-9-28(13-18)12-15-2-7-19-20(16-3-5-17(24)6-4-16)11-22(23(25)30)27-21(19)10-15/h2-7,10-11,18H,8-9,12-13H2,1H3,(H2,25,30)(H,26,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
WQNYAWXQCFECMX-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