| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2005 | 36 | Yes |
| 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) | 3.89 | 10.17 | -53.43 | 3 | 8 | -1 | 127 | 515.958 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.96 | 8.71 | -140.84 | 2 | 8 | -2 | 133 | 514.95 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.19 | -6.27 | -16.48 | 4 | 8 | 0 | 124 | 516.966 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.74 | 8.82 | -20.57 | 4 | 8 | 0 | 129 | 516.966 | 5 | ↓ |
