| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2009 | 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) | 3.22 | 11.19 | -71.04 | 1 | 8 | 0 | 96 | 464.518 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.22 | 8.67 | -57.73 | 0 | 8 | -1 | 95 | 463.51 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.22 | 10.24 | -48.49 | 2 | 8 | 1 | 94 | 465.526 | 8 | ↓ |
