| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2009 | 26 | 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) | 1.56 | 7.9 | -69.2 | 2 | 6 | 0 | 83 | 354.406 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.56 | 5.73 | -59.46 | 1 | 6 | -1 | 82 | 353.398 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.56 | 6.02 | -46.07 | 3 | 6 | 1 | 80 | 355.414 | 1 | ↓ |
