| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 29 | 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) | 3.99 | 5.74 | -14.52 | 3 | 6 | 0 | 89 | 456.34 | 5 | ↓ |
| Ref Reference (pH 7) | 3.99 | 5.83 | -14.69 | 3 | 6 | 0 | 89 | 456.34 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.99 | 6.65 | -38.28 | 2 | 6 | -1 | 92 | 455.332 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 6.6 | -43.57 | 1 | 6 | -1 | 88 | 455.332 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 6.12 | -54.55 | 1 | 6 | -1 | 88 | 455.332 | 5 | ↓ |
