| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 31 | 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) | 1.37 | 10.77 | -39.77 | 2 | 8 | 0 | 120 | 430.501 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.37 | 8.89 | -53.91 | 1 | 8 | -1 | 116 | 429.493 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.37 | 9.86 | -51.4 | 1 | 8 | -1 | 116 | 429.493 | 9 | ↓ |
