| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 31 | 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) | 3.08 | 7.06 | -63.63 | 0 | 7 | -1 | 88 | 424.473 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 9.62 | -11.93 | 0 | 7 | 0 | 82 | 425.481 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.08 | 6.24 | -15.82 | 1 | 7 | 0 | 85 | 425.481 | 9 | ↓ |
