| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: 1-(1,4-diazepan-1-yl)-2-(2-fluorophenyl)sulfanyl-ethanone 1-(1,4-diazepan-1-yl)-2-(2-fluor…
| 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) | 1.40 | 6.93 | -52.24 | 2 | 3 | 1 | 37 | 269.365 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.40 | 5.57 | -13.44 | 1 | 3 | 0 | 32 | 268.357 | 3 | ↓ |
