| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 5th, 2007 | 38 | 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) | 5.80 | 15.05 | -62.38 | 0 | 6 | -1 | 83 | 511.642 | 9 | ↓ |
| Mid Mid (pH 6-8) | 6.25 | 14.39 | -19.76 | 1 | 6 | 0 | 80 | 512.65 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 6.25 | 14.67 | -44.45 | 2 | 6 | 1 | 81 | 513.658 | 8 | ↓ |
