| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2006 | 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) | 2.87 | 8.3 | -63.07 | 0 | 7 | -1 | 92 | 423.489 | 11 | ↓ |
| Mid Mid (pH 6-8) | 2.87 | -0.37 | -12.67 | 1 | 7 | 0 | 88 | 424.497 | 11 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | -0.5 | -20.68 | 0 | 7 | 0 | 85 | 424.497 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 2.87 | -0.26 | -44.99 | 2 | 7 | 1 | 90 | 425.505 | 11 | ↓ |
