| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 31 | 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) | 3.19 | 6.6 | -12.9 | 2 | 6 | 0 | 93 | 430.541 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.19 | 7.35 | -59.89 | 1 | 6 | -1 | 96 | 429.533 | 4 | ↓ |
