| BioID | bio199314 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL174146 |
|---|
| Molecular Formula | C18H15NO2 |
|---|
| Molecular Weight | 277.32 |
|---|
| Molecular Weight (Monoisotopic) | 277.1103 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-(3,4-Methylenedioxyphenylethyl)Quinoleine |
|---|
| Smiles | c1ccc2nc(CCc3ccc4c(c3)OCO4)ccc2c1 |
|---|
| Inchi | InChI=1S/C18H15NO2/c1-2-4-16-14(3-1)7-9-15(19-16)8-5-13-6-10-17-18(11-13)21-12-20-17/h1-4,6-7,9-11H,5,8,12H2 |
|---|
| Inchi Key | ZDRLPWFUZOCXJT-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 3.0 |
|---|
| Np Likeness Score | -0.22 |
|---|
| Records Key | ['22', '5'] |
|---|
| Records Name | ['2-(2-Benzo[1,3]dioxol-5-yl-ethyl)-quinoline', '2-(3,4-methylenedioxyphenylethyl)quinoleine'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
