| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 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) | 1.47 | 2.41 | -6.18 | 0 | 3 | 0 | 25 | 216.331 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.47 | 2.89 | -48.07 | 0 | 3 | -1 | 25 | 215.323 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.47 | 2.83 | -30.83 | 1 | 3 | 1 | 27 | 217.339 | 2 | ↓ |
