| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2009 | 26 | 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) | 2.52 | -0.76 | -51.9 | 2 | 8 | -1 | 119 | 370.776 | 2 | ↓ |
| Ref Reference (pH 7) | 2.33 | 1.97 | -47.21 | 2 | 8 | -1 | 116 | 370.776 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 0.01 | -91.24 | 1 | 8 | -2 | 122 | 369.768 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 2.74 | -85.61 | 1 | 8 | -2 | 119 | 369.768 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.06 | 1.12 | -13.05 | 3 | 8 | 0 | 116 | 371.784 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 3.79 | -12.62 | 3 | 8 | 0 | 113 | 371.784 | 2 | ↓ |
