General Information of the Compound
| Compound ID |
CP0384773
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8637501, 73
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H27FN4O2
|
||||||||||||||||||
| Molecular Weight |
446.526
|
||||||||||||||||||
| Canonical SMILES |
CCN1CCCc2c(C1)c1ccc(cc1n2C)-n1ccc(OCc2ccc(F)cn2)cc1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H27FN4O2/c1-3-30-11-4-5-24-23(16-30)22-9-8-20(13-25(22)29(24)2)31-12-10-21(14-26(31)32)33-17-19-7-6-18(27)15-28-19/h6-10,12-15H,3-5,11,16-17H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
UEPBKRLZDASGSE-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