| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 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) | 3.34 | 7.7 | -59.06 | 0 | 7 | -1 | 82 | 469.945 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | 9.96 | -76.22 | 1 | 7 | 0 | 83 | 470.953 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.34 | 9.2 | -59.52 | 2 | 7 | 1 | 81 | 471.961 | 8 | ↓ |
