| 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) | 3.23 | 8.37 | -70.9 | 2 | 8 | 0 | 107 | 464.518 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 6.16 | -63.03 | 1 | 8 | -1 | 106 | 463.51 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.23 | 7.55 | -48.73 | 3 | 8 | 1 | 105 | 465.526 | 9 | ↓ |
