| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2009 | 19 | Yes |
Popular Name: (2S)-1-(azepan-1-yl)-2-[(5-bromo-2-thienyl)methylamino]propan-1-one (2S)-1-(azepan-1-yl)-2-[(5-bromo…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.42 | 8.1 | -45 | 2 | 3 | 1 | 37 | 346.314 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.42 | 6.87 | -8.42 | 1 | 3 | 0 | 32 | 345.306 | 4 | ↓ |
