General Information of the Compound
| Compound ID |
CP0516214
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9216972, 93
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H24F3N3O3
|
||||||||||||||||||
| Molecular Weight |
483.49
|
||||||||||||||||||
| Canonical SMILES |
CC(N)(CO)CCc1ccc2-c3noc(c3CCc2c1)-c1noc(c1C(F)(F)F)-c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H24F3N3O3/c1-25(30,14-33)12-11-15-7-9-18-17(13-15)8-10-19-21(18)31-35-24(19)22-20(26(27,28)29)23(34-32-22)16-5-3-2-4-6-16/h2-7,9,13,33H,8,10-12,14,30H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
YGTXBALAODOSSQ-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