General Information of the Compound
| Compound ID |
CP0515747
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9428456, 1.206
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H30FN3O2
|
||||||||||||||||||
| Molecular Weight |
423.532
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCC2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H30FN3O2/c26-21-10-8-19(9-11-21)24(30)28-23-7-3-4-18(16-23)17-29-14-12-20(13-15-29)25(31)27-22-5-1-2-6-22/h3-4,7-11,16,20,22H,1-2,5-6,12-15,17H2,(H,27,31)(H,28,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
VYIMDXFKDRCESX-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