| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2008 | 33 | 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) | 6.46 | 14.85 | -34 | 3 | 5 | 1 | 72 | 457.623 | 8 | ↓ |
| Ref Reference (pH 7) | 6.46 | 14.96 | -30.45 | 3 | 5 | 1 | 72 | 457.623 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.33 | 14.51 | -14.34 | 2 | 5 | 0 | 73 | 456.615 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.33 | 14.88 | -30.44 | 3 | 5 | 1 | 74 | 457.623 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.33 | 14.74 | -34.85 | 3 | 5 | 1 | 74 | 457.623 | 7 | ↓ |
