| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 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) | 4.39 | 11.65 | -75.06 | 1 | 6 | 0 | 74 | 475.372 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.39 | 9.12 | -56.56 | 0 | 6 | -1 | 73 | 474.364 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.39 | 10.84 | -58.7 | 2 | 6 | 1 | 71 | 476.38 | 9 | ↓ |
