| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 34 | 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) | 2.59 | 6.51 | -62.78 | 0 | 8 | -1 | 91 | 465.526 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 0.55 | -46.82 | 1 | 8 | 1 | 86 | 467.542 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.59 | 8.85 | -78.1 | 1 | 8 | 0 | 93 | 466.534 | 9 | ↓ |
