| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 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) | 2.43 | 6.43 | -59.52 | 0 | 8 | -1 | 95 | 451.499 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.43 | 8.77 | -74.45 | 1 | 8 | 0 | 96 | 452.507 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.43 | 7.96 | -57.03 | 2 | 8 | 1 | 94 | 453.515 | 9 | ↓ |
