| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 33 | 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) | 3.21 | 9.59 | -72.98 | 1 | 8 | 0 | 93 | 452.507 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 7.06 | -56.64 | 0 | 8 | -1 | 91 | 451.499 | 9 | ↓ |
