| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 24th, 2009 | 29 | No |
| 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) | 1.99 | 5.59 | -68.36 | 3 | 6 | 1 | 84 | 394.447 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 6.12 | -42.43 | 2 | 6 | 0 | 87 | 393.439 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 3.42 | -19.86 | 2 | 6 | 0 | 83 | 393.439 | 2 | ↓ |
