General Information of the Compound
| Compound ID |
CP0424522
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-bromo-6-(octylamino)-1H-pyrimidine-2,4-dione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C12H20BrN3O2
|
||||||||||||||||||
| Molecular Weight |
318.215
|
||||||||||||||||||
| Canonical SMILES |
CCCCCCCCNc1[nH]c(=O)[nH]c(=O)c1Br
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C12H20BrN3O2/c1-2-3-4-5-6-7-8-14-10-9(13)11(17)16-12(18)15-10/h2-8H2,1H3,(H3,14,15,16,17,18)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OUAQYWHEPDOLBU-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