| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2008 | 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) | 4.44 | 11.35 | -76.18 | 2 | 7 | 0 | 94 | 466.578 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.44 | 12.38 | -137.13 | 1 | 7 | -1 | 97 | 465.57 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.44 | 9.01 | -66.69 | 1 | 7 | -1 | 93 | 465.57 | 11 | ↓ |
