| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 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) | 4.04 | 10.45 | -50.37 | 0 | 8 | -1 | 97 | 516.57 | 11 | ↓ |
| Mid Mid (pH 6-8) | 4.04 | 10.34 | -16 | 1 | 8 | 0 | 95 | 517.578 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.45 | 0.52 | -16.87 | 0 | 8 | 0 | 91 | 517.578 | 11 | ↓ |
