General Information of the Compound
| Compound ID |
CP0520172
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-(5-benzoyl-6,7-dihydro-4H-[1,3]oxazolo[4,5-c]pyridin-2-yl)pyridine-3-carbonitrile
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H14N4O2
|
||||||||||||||||||
| Molecular Weight |
330.347
|
||||||||||||||||||
| Canonical SMILES |
O=C(N1CCc2oc(nc2C1)-c1ccc(cn1)C#N)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H14N4O2/c20-10-13-6-7-15(21-11-13)18-22-16-12-23(9-8-17(16)25-18)19(24)14-4-2-1-3-5-14/h1-7,11H,8-9,12H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
WTRFGUPJGAZXPS-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