| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 34 | 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) | 3.41 | 9.62 | -61.23 | 0 | 7 | -1 | 86 | 463.554 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.41 | 11.9 | -73.18 | 1 | 7 | 0 | 87 | 464.562 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.41 | 11.01 | -50.77 | 2 | 7 | 1 | 84 | 465.57 | 8 | ↓ |
