General Information of the Compound
| Compound ID |
CP0896297
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-tert-butyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-ylamine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C13H23N5
|
||||||||||||||||||
| Molecular Weight |
249.362
|
||||||||||||||||||
| Canonical SMILES |
CN1CCN(c2cc(C(C)(C)C)nc(N)n2)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C13H23N5/c1-13(2,3)10-9-11(16-12(14)15-10)18-7-5-17(4)6-8-18/h9H,5-8H2,1-4H3,(H2,14,15,16)
Show/Hide
|
||||||||||||||||||
| InChIKey |
BQCKWNHOLCQFLT-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