| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 9th, 2010 | 33 | 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) | 1.79 | 12.48 | -48.43 | 2 | 7 | 0 | 111 | 448.519 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.79 | 12.37 | -58.96 | 1 | 7 | -1 | 107 | 447.511 | 6 | ↓ |
