| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 21st, 2010 | 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) | 4.84 | 12.64 | -71.05 | 1 | 8 | 0 | 100 | 519.642 | 14 | ↓ |
| Lo Low (pH 4.5-6) | 4.84 | 11.88 | -45.46 | 2 | 8 | 1 | 97 | 520.65 | 14 | ↓ |
| Lo Low (pH 4.5-6) | 4.84 | 12.35 | -108.82 | 3 | 8 | 2 | 99 | 521.658 | 14 | ↓ |
| Lo Low (pH 4.5-6) | 4.84 | 13.09 | -110.97 | 2 | 8 | 1 | 101 | 520.65 | 14 | ↓ |
