General Information of the Compound
| Compound ID |
CP0076089
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
Benzyl-((R)-5-fluoro-1,2,3,4-tetrahydro-naphthalen-2-yl)-propyl-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H24FN
|
||||||||||||||||||
| Molecular Weight |
297.417
|
||||||||||||||||||
| Canonical SMILES |
CCCN(Cc1ccccc1)[C@@H]1CCc2c(F)cccc2C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H24FN/c1-2-13-22(15-16-7-4-3-5-8-16)18-11-12-19-17(14-18)9-6-10-20(19)21/h3-10,18H,2,11-15H2,1H3/t18-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
IZRKKTGXKLIJDE-GOSISDBHSA-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