| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 39 | 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) | 1.25 | 10.96 | -78.94 | 5 | 8 | 1 | 131 | 526.613 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 8.47 | -50.1 | 3 | 8 | -1 | 122 | 524.597 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 9.71 | -36.91 | 4 | 8 | 0 | 126 | 525.605 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 9.98 | -75.67 | 4 | 8 | 0 | 126 | 525.605 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 9.82 | -77.26 | 4 | 8 | 0 | 126 | 525.605 | 10 | ↓ |
