N-benzyl brucine
N-benzyl brucine
| SMILES | COc1cc2c(cc1OC)[C@@]13CC[N+]4(Cc5ccccc5)CC5=CCO[C@H]6CC(=O)N2[C@H]1[C@H]6[C@H]5C[C@@H]34 |
| InChIKey | XFMQETLKDRNYRE-QIBSSCBHSA-N |
Chemical Properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 485.2 |
Database connections
No bioactivity data available.
N-benzyl brucine
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
Phase II
Phase III
Phase IV