| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 32 | 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) | 3.32 | 6.51 | -112.7 | 6 | 6 | 1 | 109 | 476.688 | 13 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 5.14 | -70.95 | 5 | 6 | 0 | 105 | 475.68 | 13 | ↓ |
