| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2007 | 26 | 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) | 3.12 | -4.09 | -12.39 | 1 | 6 | 0 | 93 | 364.382 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | -3.52 | -42.45 | 0 | 6 | -1 | 95 | 363.374 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.12 | -3.98 | -46.47 | 2 | 6 | 1 | 94 | 365.39 | 3 | ↓ |
