General Information of the Compound
| Compound ID |
CP0858873
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-tert-Butyl-2-methoxy-6-(4-methylpiperazin-1-yl)pyrimidine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H24N4O
|
||||||||||||||||||
| Molecular Weight |
264.373
|
||||||||||||||||||
| Canonical SMILES |
COc1nc(N2CCN(C)CC2)cc(C(C)(C)C)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H24N4O/c1-14(2,3)11-10-12(16-13(15-11)19-5)18-8-6-17(4)7-9-18/h10H,6-9H2,1-5H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
IQEBZALLHQOKLO-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
Protein ID: PT01711, Histamine H4 receptor
Protein ID: PT02519, Histamine H4 receptor