| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 15th, 2010 | 35 | 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) | 3.89 | 7.2 | -52.28 | 3 | 7 | 1 | 74 | 467.549 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.89 | 5.89 | -17.25 | 2 | 7 | 0 | 69 | 466.541 | 2 | ↓ |
