| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 21st, 2009 | 45 | 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) | 8.95 | 22.18 | -83.55 | 2 | 5 | 2 | 44 | 624.891 | 10 | ↓ |
| Hi High (pH 8-9.5) | 8.95 | 19.61 | -42.34 | 1 | 5 | 1 | 43 | 623.883 | 10 | ↓ |
