| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 25th, 2008 | 31 | 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) | 2.61 | 7.64 | -62.25 | 0 | 7 | -1 | 86 | 423.489 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 8.42 | -62.51 | 2 | 7 | 1 | 84 | 425.505 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.61 | 9.97 | -81.12 | 1 | 7 | 0 | 87 | 424.497 | 7 | ↓ |
