compound 3a [Badolato et al., 2019]
compound 3a [Badolato et al., 2019]
| SMILES | O=C1C(Cl)=C(N2CCOCC2)C(=O)c2c(O)ccc(O)c21 |
| InChIKey | FTMCZTSKCXEXCO-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 1 |
| Molecular weight (Da) | 309.0 |
Database connections
No bioactivity data available.
compound 3a [Badolato et al., 2019]
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0