| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 36 | 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) | 3.55 | 8 | -64.21 | 0 | 8 | -1 | 95 | 489.548 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.55 | 10.34 | -76.06 | 1 | 8 | 0 | 96 | 490.556 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.55 | 9.53 | -48.31 | 2 | 8 | 1 | 94 | 491.564 | 8 | ↓ |
