| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 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) | 5.25 | 16.48 | -50.37 | 2 | 8 | 1 | 101 | 499.591 | 10 | ↓ |
| Hi High (pH 8-9.5) | 5.25 | 14.11 | -15.97 | 1 | 8 | 0 | 100 | 498.583 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 5.25 | 16.96 | -89.33 | 3 | 8 | 2 | 103 | 500.599 | 10 | ↓ |
