General Information of the Compound
| Compound ID |
CP0059509
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(8R)-N-(4-cyanophenyl)-8-[4-(trifluoromethyl)phenyl]-6,8-dihydro-5H-1,7-naphthyridine-7-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H17F3N4O
|
||||||||||||||||||
| Molecular Weight |
422.41
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)c1ccc(cc1)[C@H]1N(CCc2cccnc12)C(=O)Nc1ccc(cc1)C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H17F3N4O/c24-23(25,26)18-7-5-17(6-8-18)21-20-16(2-1-12-28-20)11-13-30(21)22(31)29-19-9-3-15(14-27)4-10-19/h1-10,12,21H,11,13H2,(H,29,31)/t21-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
PJWAFJPMMZFFDP-OAQYLSRUSA-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