| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 23 | 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) | 2.72 | 7.39 | -60.46 | 3 | 5 | 1 | 75 | 330.433 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.72 | 5.95 | -14.72 | 2 | 5 | 0 | 71 | 329.425 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 6.33 | -47.76 | 2 | 5 | 0 | 79 | 329.425 | 4 | ↓ |
