General Information of the Compound
| Compound ID |
CP0447797
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-(5-Acetylamino-6,7-dimethoxy-4-oxo-4H-quinazolin-3-yl)-butyric acid ethyl ester
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H23N3O6
|
||||||||||||||||||
| Molecular Weight |
377.397
|
||||||||||||||||||
| Canonical SMILES |
CCOC(=O)CCCn1cnc2cc(OC)c(OC)c(NC(C)=O)c2c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H23N3O6/c1-5-27-14(23)7-6-8-21-10-19-12-9-13(25-3)17(26-4)16(20-11(2)22)15(12)18(21)24/h9-10H,5-8H2,1-4H3,(H,20,22)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UZAROBVJCJVDHX-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