| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 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) | 5.36 | 4.96 | -15.59 | 3 | 7 | 0 | 98 | 412.438 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.36 | 6.82 | -125.52 | 1 | 7 | -2 | 103 | 410.422 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.36 | 5.88 | -53.56 | 2 | 7 | -1 | 100 | 411.43 | 6 | ↓ |
