5-Cl-5-deoxy-(±)-ENBA [273]
5-Cl-5-deoxy-(±)-ENBA
| SMILES | OC1C(CCl)OC(n2cnc3c(NC4CC5CCC4C5)ncnc32)C1O |
| InChIKey | PVJGDYDNVNCGBT-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 4 |
| Log P | 1.285 |
| Molecular weight (Da) | 379.1 |
| Stereochemistry info | unspecified |
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| Protein | Gene | Species | Family | Class | Type | Min | Avg | Max | Database |
5-Cl-5-deoxy-(±)-ENBA
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