| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 34 | 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) | 2.35 | 8.46 | -63.25 | 0 | 8 | -1 | 90 | 459.526 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 10.81 | -46.35 | 2 | 8 | 1 | 89 | 461.542 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 11.23 | -90.94 | 3 | 8 | 2 | 90 | 462.55 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.35 | 10.79 | -78.33 | 1 | 8 | 0 | 91 | 460.534 | 7 | ↓ |
