| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2007 | 35 | 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) | 2.75 | 7.8 | -57.5 | 0 | 8 | -1 | 107 | 501.556 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | -4.27 | -17.85 | 0 | 8 | 0 | 101 | 502.564 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.75 | 6.98 | -17.19 | 1 | 8 | 0 | 104 | 502.564 | 8 | ↓ |
