| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 8th, 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) | 3.37 | 10.8 | -47.56 | 0 | 7 | -1 | 95 | 450.471 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 8.9 | -26.04 | 1 | 7 | 0 | 93 | 451.479 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 9.89 | -16.99 | 0 | 7 | 0 | 89 | 451.479 | 7 | ↓ |
