| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 28 | 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) | 2.37 | 1.77 | -51.44 | 1 | 8 | -1 | 112 | 371.38 | 2 | ↓ |
| Ref Reference (pH 7) | 2.18 | 4.49 | -46.64 | 1 | 8 | -1 | 109 | 371.38 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.91 | 3.65 | -13.34 | 2 | 8 | 0 | 109 | 372.388 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.37 | 2.2 | -75.26 | 2 | 8 | 0 | 113 | 372.388 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.91 | 4.09 | -46.15 | 3 | 8 | 1 | 110 | 373.396 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 6.74 | -47.24 | 3 | 8 | 1 | 107 | 373.396 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.18 | 4.92 | -71.76 | 2 | 8 | 0 | 110 | 372.388 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 6.3 | -12.86 | 2 | 8 | 0 | 106 | 372.388 | 2 | ↓ |
