| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2009 | 37 | 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) | 3.17 | 13.58 | -75.48 | 1 | 8 | 0 | 102 | 514.607 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.17 | 13.06 | -61.61 | 0 | 8 | -1 | 100 | 513.599 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.17 | 12.83 | -50.01 | 2 | 8 | 1 | 99 | 515.615 | 9 | ↓ |
