General Information of the Compound
| Compound ID |
CP0571963
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[(2,4-dichlorophenyl)methyl]-3-(2,2-difluoroethyl)-1-[(5-fluoro-1H-imidazo[4,5-b]pyridin-2-yl)methyl]imidazol-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H14Cl2F3N5O
|
||||||||||||||||||
| Molecular Weight |
456.255
|
||||||||||||||||||
| Canonical SMILES |
FC(F)Cn1c(Cc2ccc(Cl)cc2Cl)cn(Cc2nc3nc(F)ccc3[nH]2)c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H14Cl2F3N5O/c20-11-2-1-10(13(21)6-11)5-12-7-28(19(30)29(12)8-15(22)23)9-17-25-14-3-4-16(24)26-18(14)27-17/h1-4,6-7,15H,5,8-9H2,(H,25,26,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OAALDXLDQOCVNA-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