| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 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) | 0.86 | 2.5 | -56.89 | 1 | 8 | -1 | 106 | 442.517 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.86 | 4.77 | -65.98 | 2 | 8 | 0 | 107 | 443.525 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.86 | 4.02 | -48.52 | 3 | 8 | 1 | 104 | 444.533 | 6 | ↓ |
