| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 17th, 2009 | 27 | 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) | 1.73 | 6.84 | -21.3 | 2 | 6 | 0 | 81 | 400.481 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 7.64 | -60.11 | 1 | 6 | -1 | 83 | 399.473 | 4 | ↓ |
