| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2010 | 13 | Yes |
| 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) | -0.89 | 3.59 | -49.81 | 2 | 3 | 1 | 47 | 177.227 | 1 | ↓ |
| Hi High (pH 8-9.5) | -0.89 | 2.32 | -7.6 | 1 | 3 | 0 | 42 | 176.219 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.89 | 4.05 | -114.54 | 3 | 3 | 2 | 48 | 178.235 | 1 | ↓ |
