| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2005 | 27 | 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) | 3.14 | 8.85 | -9.31 | 1 | 6 | 0 | 86 | 446.326 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 6.86 | -42.43 | 0 | 6 | -1 | 93 | 445.318 | 5 | ↓ |
