General Information of the Compound
| Compound ID |
CP0553659
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4,5-dimethyl-2-[(8-methyl-[1,3]dioxolo[4,5-g]quinazolin-6-yl)amino]-1H-pyrimidin-6-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H15N5O3
|
||||||||||||||||||
| Molecular Weight |
325.328
|
||||||||||||||||||
| Canonical SMILES |
Cc1nc(Nc2nc(=O)c(C)c(C)[nH]2)nc2cc3OCOc3cc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H15N5O3/c1-7-8(2)17-16(20-14(7)22)21-15-18-9(3)10-4-12-13(24-6-23-12)5-11(10)19-15/h4-5H,6H2,1-3H3,(H2,17,18,19,20,21,22)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XQMXKJZDDBNRCO-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
Protein ID: PT02212, Signal transducer and activator of transcription 1-alpha/beta
Protein ID: PT01503, Signal transducer and activator of transcription 3