| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2009 | 34 | 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) | 1.73 | 11.61 | -48.3 | 1 | 6 | -1 | 90 | 471.455 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 12.2 | -42.05 | 2 | 6 | 0 | 94 | 472.463 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 12.53 | -37.52 | 2 | 6 | 0 | 94 | 472.463 | 8 | ↓ |
