| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2010 | 28 | 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) | 3.11 | 9.31 | -38.08 | 6 | 7 | 1 | 118 | 376.44 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 9.37 | -16.69 | 5 | 7 | 0 | 117 | 375.432 | 4 | ↓ |
