General Information of the Compound
| Compound ID |
CP0946275
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
Isopropyl-(5-methoxy-2-pyridin-2-yl-pyrimidin-4-yl)-methyl-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H18N4O
|
||||||||||||||||||
| Molecular Weight |
258.325
|
||||||||||||||||||
| Canonical SMILES |
COc1cnc(-c2ccccn2)nc1N(C)C(C)C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H18N4O/c1-10(2)18(3)14-12(19-4)9-16-13(17-14)11-7-5-6-8-15-11/h5-10H,1-4H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
PFSADRKLQBMTGW-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