| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2009 | 30 | 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) | 2.54 | 7.56 | -15.06 | 2 | 8 | 0 | 101 | 446.916 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.07 | 6.45 | -47.4 | 1 | 8 | -1 | 103 | 445.908 | 8 | ↓ |
