| BioID | bio199343 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1830157 |
|---|
| Molecular Formula | C26H25NO4 |
|---|
| Molecular Weight | 415.49 |
|---|
| Molecular Weight (Monoisotopic) | 415.1784 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | Rac-2-(Benzyloxy)Isodomesticine |
|---|
| Smiles | COc1c(OCc2ccccc2)cc2c3c1-c1cc4c(cc1CC3N(C)CC2)OCO4 |
|---|
| Inchi | InChI=1S/C26H25NO4/c1-27-9-8-17-11-23(29-14-16-6-4-3-5-7-16)26(28-2)25-19-13-22-21(30-15-31-22)12-18(19)10-20(27)24(17)25/h3-7,11-13,20H,8-10,14-15H2,1-2H3 |
|---|
| Inchi Key | CNEITGDRTCOSGQ-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 2.0 |
|---|
| Np Likeness Score | 0.91 |
|---|
| Records Key | ['14f'] |
|---|
| Records Name | ['rac-2-(Benzyloxy)isodomesticine'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
