| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 34 | No |
None
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) | 5.37 | 11.76 | -40.29 | 2 | 5 | 1 | 58 | 455.578 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.37 | 10.25 | -44.71 | 0 | 5 | -1 | 60 | 453.562 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.37 | 9.49 | -8.85 | 1 | 5 | 0 | 57 | 454.57 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.37 | 12.52 | -49.85 | 1 | 5 | 0 | 61 | 454.57 | 5 | ↓ |
