| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 38 | 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) | 3.16 | 9.76 | -33.53 | 4 | 14 | 1 | 181 | 520.53 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 7.72 | -13.57 | 3 | 14 | 0 | 180 | 519.522 | 9 | ↓ |
