| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 23rd, 2010 | 21 | Yes |
Popular Name: 3-[4-[(5-fluoro-3-pyridyl)sulfonyl]-1,4-diazepan-1-yl]propan-1-amine 3-[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) | -0.27 | 0.06 | -50.64 | 3 | 6 | 1 | 81 | 317.41 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.27 | -0.33 | -8.33 | 2 | 6 | 0 | 80 | 316.402 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.27 | 1.69 | -45.42 | 3 | 6 | 1 | 81 | 317.41 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.27 | 2.07 | -119.02 | 4 | 6 | 2 | 82 | 318.418 | 5 | ↓ |
