| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 23rd, 2010 | 20 | Yes |
Popular Name: 2-[4-[(5-fluoro-3-pyridyl)sulfonyl]-1,4-diazepan-1-yl]ethanamine 2-[4-[(5-fluoro-3-pyridyl)sulfon…
| 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) | -0.54 | -0.72 | -51.89 | 3 | 6 | 1 | 81 | 303.383 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.54 | 0.91 | -43.96 | 3 | 6 | 1 | 81 | 303.383 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.54 | 1.29 | -129.81 | 4 | 6 | 2 | 82 | 304.391 | 4 | ↓ |
