| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 17th, 2007 | 33 | 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) | 6.13 | 12.79 | -52.56 | 0 | 5 | -1 | 73 | 498.342 | 4 | ↓ |
| Mid Mid (pH 6-8) | 6.57 | 12.12 | -20.75 | 1 | 5 | 0 | 71 | 499.35 | 3 | ↓ |
| Mid Mid (pH 6-8) | 5.54 | -0.32 | -12.76 | 0 | 5 | 0 | 67 | 499.35 | 4 | ↓ |
