| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 29 | 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) | 2.06 | 11.08 | -48.46 | 3 | 9 | 1 | 103 | 403.507 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.13 | 9.61 | -85.94 | 2 | 9 | 0 | 109 | 402.499 | 8 | ↓ |
