| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 3rd, 2010 | 29 | Yes |
| 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) | 3.28 | 9.83 | -48.05 | 3 | 5 | 1 | 63 | 400.518 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.28 | 7.85 | -11.28 | 2 | 5 | 0 | 61 | 399.51 | 9 | ↓ |
