| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 1st, 2006 | 29 | 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) | 3.96 | 1.89 | -10.51 | 3 | 6 | 0 | 100 | 399.487 | 0 | ↓ |
| Hi High (pH 8-9.5) | 3.96 | 2.67 | -46.4 | 2 | 6 | -1 | 102 | 398.479 | 0 | ↓ |
