| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 20 | 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) | 2.54 | 7.08 | -97.23 | 4 | 3 | 2 | 41 | 278.44 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 7.4 | -42.26 | 3 | 3 | 1 | 44 | 277.432 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 6 | -33.52 | 3 | 3 | 1 | 37 | 277.432 | 5 | ↓ |
