| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2006 | 20 | 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) | 4.47 | 7.61 | -42.57 | 0 | 3 | -1 | 44 | 299.4 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.42 | 5.68 | -48.39 | 0 | 3 | -1 | 48 | 299.4 | 2 | ↓ |
| Hi High (pH 8-9.5) | 5.42 | 6.35 | -47.31 | 0 | 3 | -1 | 48 | 299.4 | 2 | ↓ |
