| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 20th, 2011 | 17 | 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) | 3.02 | 1.36 | -9.54 | 2 | 4 | 0 | 67 | 236.267 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 2.14 | -50.12 | 1 | 4 | -1 | 70 | 235.259 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 3.66 | -45.42 | 1 | 4 | -1 | 70 | 235.259 | 1 | ↓ |
