| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 12 | 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) | 1.71 | 2.77 | -32.63 | 3 | 3 | 1 | 47 | 163.2 | 0 | ↓ |
| Hi High (pH 8-9.5) | 1.71 | 2.85 | -4.88 | 2 | 3 | 0 | 45 | 162.192 | 0 | ↓ |
| Hi High (pH 8-9.5) | 1.71 | 2.82 | -4.37 | 2 | 3 | 0 | 45 | 162.192 | 0 | ↓ |
