| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 35 | 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) | 6.12 | 11.21 | -13.87 | 2 | 6 | 0 | 78 | 467.569 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.09 | 11.62 | -53.73 | 0 | 6 | -1 | 77 | 466.561 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.09 | 11.82 | -57.9 | 0 | 6 | -1 | 77 | 466.561 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.12 | 12.13 | -45.12 | 1 | 6 | -1 | 81 | 466.561 | 7 | ↓ |
| Mid Mid (pH 6-8) | 6.12 | 11.98 | -53.96 | 1 | 6 | -1 | 81 | 466.561 | 7 | ↓ |
