General Information of the Compound
| Compound ID |
CP0477321
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-[(4-fluorophenyl)methyl]-3-(3-hydroxypropyl)-6-methoxy-1-methylquinazoline-2,4-dione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H21FN2O4
|
||||||||||||||||||
| Molecular Weight |
372.396
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc2n(C)c(=O)n(CCCO)c(=O)c2c1Cc1ccc(F)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H21FN2O4/c1-22-16-8-9-17(27-2)15(12-13-4-6-14(21)7-5-13)18(16)19(25)23(20(22)26)10-3-11-24/h4-9,24H,3,10-12H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
KAAXWZBZKKWODH-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