| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2009 | 31 | 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) | 3.54 | 11.85 | -20.21 | 1 | 9 | 0 | 109 | 440.529 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.61 | 10.94 | -47.68 | 0 | 9 | -1 | 115 | 439.521 | 5 | ↓ |
