| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2004 | 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) | 4.36 | 12.04 | -20.28 | 2 | 6 | 0 | 80 | 438.94 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.54 | 11.92 | -46.52 | 1 | 6 | -1 | 82 | 437.932 | 4 | ↓ |
