General Information of the Compound
| Compound ID |
CP0556107
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-[2-(4-tert-butylphenyl)ethylamino]-1H-pyrimidine-2,4-dione
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H21N3O2
|
||||||||||||||||||
| Molecular Weight |
287.363
|
||||||||||||||||||
| Canonical SMILES |
CC(C)(C)c1ccc(CCNc2cc(=O)[nH]c(=O)[nH]2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H21N3O2/c1-16(2,3)12-6-4-11(5-7-12)8-9-17-13-10-14(20)19-15(21)18-13/h4-7,10H,8-9H2,1-3H3,(H3,17,18,19,20,21)
Show/Hide
|
||||||||||||||||||
| InChIKey |
BMQLIGYBLIRCMC-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