| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 27th, 2011 | 13 | 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) | 2.01 | 2.74 | -105.72 | 6 | 2 | 2 | 55 | 188.359 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 2.46 | -33.5 | 5 | 2 | 1 | 54 | 187.351 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 2.61 | -37.72 | 5 | 2 | 1 | 54 | 187.351 | 4 | ↓ |
