| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 32 | 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) | 3.12 | 7 | -23.1 | 2 | 6 | 0 | 101 | 448.531 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 7.76 | -75.23 | 1 | 6 | -1 | 104 | 447.523 | 5 | ↓ |
