| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2008 | 30 | 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) | 4.04 | 8.96 | -21.53 | 2 | 6 | 0 | 83 | 416.506 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.04 | 9.03 | -42.66 | 1 | 6 | -1 | 81 | 415.498 | 6 | ↓ |
