| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 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) | 4.51 | 11.61 | -37.27 | 0 | 8 | -1 | 109 | 511.963 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.96 | -0.13 | -33.46 | 1 | 8 | 0 | 106 | 512.971 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.92 | 0.16 | -25.7 | 0 | 8 | 0 | 102 | 512.971 | 8 | ↓ |
