| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 26 | 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) | 2.69 | 5.89 | -57.19 | 1 | 5 | -1 | 81 | 419.226 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 5.96 | -13.04 | 1 | 5 | 0 | 75 | 420.234 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.14 | 5.8 | -20.74 | 2 | 5 | 0 | 78 | 420.234 | 4 | ↓ |
