| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 37 | 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) | 4.17 | 8.11 | -17.29 | 2 | 9 | 0 | 106 | 509.603 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.94 | 8.74 | -52.56 | 0 | 9 | -1 | 105 | 508.595 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.94 | 8.38 | -58.82 | 0 | 9 | -1 | 105 | 508.595 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.17 | 9.27 | -42.4 | 1 | 9 | -1 | 109 | 508.595 | 10 | ↓ |
