| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 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) | 2.03 | 10.16 | -37.84 | 2 | 4 | 1 | 42 | 324.495 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.48 | 8.87 | -48.75 | 1 | 4 | 0 | 45 | 323.487 | 5 | ↓ |
