| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | 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) | 1.25 | 0.5 | -11.8 | 2 | 5 | 0 | 70 | 277.32 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 1.42 | -44.3 | 1 | 5 | -1 | 73 | 276.312 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 2.68 | -44.54 | 3 | 5 | 1 | 71 | 278.328 | 3 | ↓ |
