General Information of the Compound
| Compound ID |
CP0560443
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
9-methoxy-1-methylsulfanyl-4-propyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one
Show/Hide
|
||||||||||||||||||
| Formula |
C14H16N4O2S
|
||||||||||||||||||
| Molecular Weight |
304.375
|
||||||||||||||||||
| Canonical SMILES |
CCCn1c2nnc(SC)n2c2c(OC)cccc2c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H16N4O2S/c1-4-8-17-12(19)9-6-5-7-10(20-2)11(9)18-13(17)15-16-14(18)21-3/h5-7H,4,8H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
LUUOYBKUMHZMOW-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 | |||||||||||||||||||
| 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