| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 18 | 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) | 1.47 | -0.55 | -59.61 | 2 | 5 | -1 | 96 | 263.298 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.47 | -1.9 | -50.89 | 2 | 5 | -1 | 90 | 263.298 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.84 | 1.56 | -16.6 | 3 | 5 | 0 | 89 | 264.306 | 2 | ↓ |
