| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 33 | 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) | 4.10 | 5.79 | -18.25 | 3 | 8 | 0 | 108 | 516.392 | 7 | ↓ |
| Ref Reference (pH 7) | 4.10 | 5.51 | -13.79 | 3 | 8 | 0 | 108 | 516.392 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.10 | 6.57 | -42.77 | 2 | 8 | -1 | 111 | 515.384 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.88 | 5.66 | -45.3 | 1 | 8 | -1 | 107 | 515.384 | 7 | ↓ |
