| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 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) | 1.96 | 7.89 | -75.07 | 1 | 9 | 0 | 102 | 468.506 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.96 | 5.35 | -60.49 | 0 | 9 | -1 | 101 | 467.498 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.96 | 7.07 | -55.19 | 2 | 9 | 1 | 99 | 469.514 | 8 | ↓ |
