General Information of the Compound
| Compound ID |
CP0565139
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US9428456, 1.284
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H29F3N6O2
|
||||||||||||||||||
| Molecular Weight |
490.53
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)c1cccc(n1)C(=O)Nc1ccnc(CN2CCC(CC2)C(=O)NC2CCCCC2)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H29F3N6O2/c25-24(26,27)19-8-4-7-18(30-19)23(35)32-20-9-12-28-21(31-20)15-33-13-10-16(11-14-33)22(34)29-17-5-2-1-3-6-17/h4,7-9,12,16-17H,1-3,5-6,10-11,13-15H2,(H,29,34)(H,28,31,32,35)
Show/Hide
|
||||||||||||||||||
| InChIKey |
BUEKMZAAXYBCJP-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