| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 36 | No |
None
| 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) | -2.84 | 1.08 | -94.82 | 6 | 13 | -1 | 219 | 499.456 | 11 | ↓ |
| Hi High (pH 8-9.5) | -2.84 | 0.97 | -100.64 | 5 | 13 | -2 | 218 | 498.448 | 11 | ↓ |
| Hi High (pH 8-9.5) | -2.84 | 2.23 | -133.66 | 5 | 13 | -2 | 222 | 498.448 | 11 | ↓ |
| Hi High (pH 8-9.5) | -2.84 | 2.03 | -144.13 | 5 | 13 | -2 | 222 | 498.448 | 11 | ↓ |
| Hi High (pH 8-9.5) | -2.84 | 0.74 | -102.33 | 5 | 13 | -2 | 218 | 498.448 | 11 | ↓ |
