| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 34 | 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) | 4.00 | 6.6 | -17.92 | 3 | 8 | 0 | 108 | 465.55 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.77 | 6.49 | -62.23 | 1 | 8 | -1 | 107 | 464.542 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.77 | 6.97 | -55.47 | 1 | 8 | -1 | 107 | 464.542 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.00 | 7.17 | -47.49 | 2 | 8 | -1 | 111 | 464.542 | 9 | ↓ |
