| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2006 | 21 | 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) | 3.47 | 7.2 | -13.41 | 2 | 4 | 0 | 54 | 295.367 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 7.09 | -43.08 | 1 | 4 | -1 | 56 | 294.359 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.47 | 8.17 | -29.43 | 3 | 4 | 1 | 55 | 296.375 | 4 | ↓ |
