| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 24th, 2006 | 13 | 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) | 1.71 | 1.38 | -6.35 | 3 | 4 | 0 | 71 | 240.06 | 0 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | -0.77 | -45.45 | 2 | 4 | -1 | 74 | 239.052 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 1.53 | 1.06 | -125.88 | 5 | 4 | 2 | 71 | 242.076 | 1 | ↓ |
