| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 36 | Yes |
| 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) | 3.54 | 8.26 | -42.64 | 3 | 8 | 1 | 104 | 529.086 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.22 | 8.01 | -14.39 | 2 | 8 | 0 | 102 | 528.078 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.54 | 6.23 | -11.99 | 2 | 8 | 0 | 103 | 528.078 | 5 | ↓ |
