| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 16th, 2009 | 24 | Yes |
None
| 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) | 0.84 | 0.02 | -56.76 | 1 | 8 | -1 | 112 | 321.32 | 2 | ↓ |
| Ref Reference (pH 7) | 0.66 | 2.72 | -53.87 | 1 | 8 | -1 | 109 | 321.32 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.84 | 0.48 | -75.94 | 2 | 8 | 0 | 113 | 322.328 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.38 | 2.36 | -47.81 | 3 | 8 | 1 | 110 | 323.336 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.38 | 1.9 | -15.86 | 2 | 8 | 0 | 109 | 322.328 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.20 | 4.54 | -16.63 | 2 | 8 | 0 | 106 | 322.328 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.20 | 5 | -48.09 | 3 | 8 | 1 | 107 | 323.336 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.66 | 3.18 | -72.27 | 2 | 8 | 0 | 110 | 322.328 | 2 | ↓ |
