| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 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) | 2.96 | 6.44 | -114.7 | 6 | 6 | 1 | 109 | 462.661 | 13 | ↓ |
| Hi High (pH 8-9.5) | 2.96 | 5.09 | -72.32 | 5 | 6 | 0 | 105 | 461.653 | 13 | ↓ |
