| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 37 | 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) | 5.15 | 12.85 | -59.67 | 0 | 8 | -1 | 109 | 519.599 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.56 | 12.94 | -20.55 | 0 | 8 | 0 | 103 | 520.607 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.59 | 11.92 | -30.56 | 1 | 8 | 0 | 106 | 520.607 | 8 | ↓ |
