| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 31 | 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) | 2.17 | 5.87 | -61.31 | 0 | 8 | -1 | 95 | 445.879 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.62 | 6.9 | -57.84 | 2 | 8 | 1 | 94 | 447.895 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.59 | 8.12 | -59.88 | 1 | 8 | 1 | 90 | 447.895 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 8.21 | -72.61 | 1 | 8 | 0 | 96 | 446.887 | 7 | ↓ |
