General Information of the Compound
| Compound ID |
CP0429795
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N,N-dimethyl-2-[methyl-[pyrimidin-4-ylmethyl(5,6,7,8-tetrahydroquinolin-8-yl)amino]amino]ethanamine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H28N6
|
||||||||||||||||||
| Molecular Weight |
340.475
|
||||||||||||||||||
| Canonical SMILES |
CN(C)CCN(C)N(Cc1ccncn1)C1CCCc2cccnc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H28N6/c1-23(2)12-13-24(3)25(14-17-9-11-20-15-22-17)18-8-4-6-16-7-5-10-21-19(16)18/h5,7,9-11,15,18H,4,6,8,12-14H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
GVSCHAAKHKSNHD-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