| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 39 | Yes |
| 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) | 4.80 | 9.44 | -18.67 | 3 | 8 | 0 | 108 | 527.621 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.57 | 9.98 | -49.52 | 1 | 8 | -1 | 107 | 526.613 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.57 | 9.68 | -61.55 | 1 | 8 | -1 | 107 | 526.613 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.80 | 10.53 | -44.52 | 2 | 8 | -1 | 111 | 526.613 | 10 | ↓ |
