| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2009 | 30 | 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) | 0.56 | 5.24 | -49.41 | 1 | 9 | -1 | 129 | 423.43 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.56 | 6.04 | -108.72 | 0 | 9 | -2 | 131 | 422.422 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.56 | 3.95 | -22.42 | 2 | 9 | 0 | 126 | 424.438 | 5 | ↓ |
