General Information of the Compound
| Compound ID |
CP0436598
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N'-[(6-methylpyridin-2-yl)methyl]-N'-(5,6,7,8-tetrahydroquinolin-8-yl)butane-1,4-diamine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H28N4
|
||||||||||||||||||
| Molecular Weight |
324.472
|
||||||||||||||||||
| Canonical SMILES |
Cc1cccc(CN(CCCCN)C2CCCc3cccnc23)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H28N4/c1-16-7-4-10-18(23-16)15-24(14-3-2-12-21)19-11-5-8-17-9-6-13-22-20(17)19/h4,6-7,9-10,13,19H,2-3,5,8,11-12,14-15,21H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
DYNCUXHVLGCFAT-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