General Information of the Compound
| Compound ID |
CP0953844
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(5-cyano-2-(4-(2,4-difluorophenoxy)piperidin-1-yl)phenyl)-6,7-dihvdro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H23F2N5O3
|
||||||||||||||||||
| Molecular Weight |
479.487
|
||||||||||||||||||
| Canonical SMILES |
N#Cc1ccc(N2CCC(Oc3ccc(F)cc3F)CC2)c(NC(=O)c2cnn3c2OCCC3)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H23F2N5O3/c26-17-3-5-23(20(27)13-17)35-18-6-9-31(10-7-18)22-4-2-16(14-28)12-21(22)30-24(33)19-15-29-32-8-1-11-34-25(19)32/h2-5,12-13,15,18H,1,6-11H2,(H,30,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
TXODBDFYRVKZCU-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