General Information of the Compound
| Compound ID |
CP0504811
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-[(7-amino-5-cyclopropyltriazolo[4,5-d]pyrimidin-3-yl)methyl]-4-butylmorpholin-3-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H23N7O2
|
||||||||||||||||||
| Molecular Weight |
345.407
|
||||||||||||||||||
| Canonical SMILES |
CCCCN1CC(Cn2nnc3c(N)nc(nc23)C2CC2)OCC1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H23N7O2/c1-2-3-6-22-7-11(25-9-12(22)24)8-23-16-13(20-21-23)14(17)18-15(19-16)10-4-5-10/h10-11H,2-9H2,1H3,(H2,17,18,19)
Show/Hide
|
||||||||||||||||||
| InChIKey |
TVDDTKOBIXXCAE-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