| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2009 | 32 | 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) | 4.25 | 10.03 | -51.47 | 2 | 8 | -1 | 102 | 471.632 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.07 | 8.95 | -88.86 | 1 | 8 | -2 | 108 | 470.624 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.53 | 10.19 | -20.14 | 3 | 8 | 0 | 105 | 472.64 | 7 | ↓ |
