General Information of the Compound
| Compound ID |
CP0926330
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(E)-[1-[1-[6-(8-fluoro-2-naphthyl)-2-oxo-1H-pyridin-3-yl]-2-methyl-propyl]imidazolidin-2-ylidene]cyanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H22FN5O
|
||||||||||||||||||
| Molecular Weight |
403.461
|
||||||||||||||||||
| Canonical SMILES |
CC(C)C(c1ccc(-c2ccc3cccc(F)c3c2)[nH]c1=O)N1CCN/C1=N\C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H22FN5O/c1-14(2)21(29-11-10-26-23(29)27-13-25)17-8-9-20(28-22(17)30)16-7-6-15-4-3-5-19(24)18(15)12-16/h3-9,12,14,21H,10-11H2,1-2H3,(H,26,27)(H,28,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SHGAKPXLJNIFBQ-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