General Information of the Compound
| Compound ID |
CP0966838
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-(8-fluoro-2-naphthyl)-3-[2-methyl-1-(4H-1,2,4-triazol-3-ylamino)propyl]-1H-pyridin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H20FN5O
|
||||||||||||||||||
| Molecular Weight |
377.423
|
||||||||||||||||||
| Canonical SMILES |
CC(C)C(Nc1nnc[nH]1)c1ccc(-c2ccc3cccc(F)c3c2)[nH]c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H20FN5O/c1-12(2)19(26-21-23-11-24-27-21)15-8-9-18(25-20(15)28)14-7-6-13-4-3-5-17(22)16(13)10-14/h3-12,19H,1-2H3,(H,25,28)(H2,23,24,26,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JZQCJXRTDMYCEG-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