| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 33 | 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) | 3.01 | 9.25 | -70.21 | 1 | 8 | 0 | 96 | 450.491 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.01 | 6.86 | -60.28 | 0 | 8 | -1 | 95 | 449.483 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.01 | 8.58 | -48.53 | 2 | 8 | 1 | 94 | 451.499 | 8 | ↓ |
