| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 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) | 3.63 | 10.05 | -61.5 | 0 | 8 | -1 | 95 | 515.586 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | 11.32 | -60.49 | 2 | 8 | 1 | 94 | 517.602 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 12.31 | -59.57 | 1 | 8 | 1 | 90 | 517.602 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | 12.39 | -78.09 | 1 | 8 | 0 | 96 | 516.594 | 10 | ↓ |
