| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 22 | 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) | 3.88 | 7.35 | -49.3 | 3 | 3 | 1 | 46 | 294.374 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.88 | 5.93 | -9.4 | 2 | 3 | 0 | 41 | 293.366 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.88 | 8.13 | -71.24 | 2 | 3 | 0 | 49 | 293.366 | 6 | ↓ |
