| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2011 | 24 | 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) | 1.54 | 7.07 | -98.01 | 4 | 6 | 2 | 67 | 344.544 | 13 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 2.52 | -13.12 | 2 | 6 | 0 | 65 | 342.528 | 13 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 4.72 | -37.81 | 3 | 6 | 1 | 66 | 343.536 | 13 | ↓ |
