| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 30 | 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) | 2.98 | 5.97 | -16.99 | 2 | 8 | 0 | 104 | 446.554 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.98 | 5.85 | -43.89 | 1 | 8 | -1 | 106 | 445.546 | 8 | ↓ |
