General Information of the Compound
| Compound ID |
CP0544592
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-N-cyclohexyl-2-N-methyl-6-pyridin-2-ylpyrimidine-2,4-diamine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C16H21N5
|
||||||||||||||||||
| Molecular Weight |
283.379
|
||||||||||||||||||
| Canonical SMILES |
CNc1nc(NC2CCCCC2)cc(n1)-c1ccccn1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C16H21N5/c1-17-16-20-14(13-9-5-6-10-18-13)11-15(21-16)19-12-7-3-2-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3,(H2,17,19,20,21)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ICZMAQAUPZLREN-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 | |||||||||||||||||||
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