| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 33 | No |
| 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) | 2.81 | 6.98 | -61.59 | 1 | 7 | -1 | 99 | 442.447 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.22 | -2.31 | -23.44 | 1 | 7 | 0 | 93 | 443.455 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.25 | -2.59 | -30.06 | 2 | 7 | 0 | 96 | 443.455 | 4 | ↓ |
