| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 1st, 2009 | 33 | 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) | 3.15 | 9.58 | -46.05 | 4 | 11 | 1 | 142 | 454.559 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.15 | 7.34 | -14.47 | 3 | 11 | 0 | 140 | 453.551 | 10 | ↓ |
