| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 32 | No |
| 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) | 2.76 | -0.41 | -16.31 | 1 | 8 | 0 | 105 | 450.52 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | -0.52 | -20.78 | 0 | 8 | 0 | 102 | 450.52 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.76 | -0.3 | -40.07 | 2 | 8 | 1 | 106 | 451.528 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.18 | -0.41 | -47.47 | 1 | 8 | 1 | 103 | 451.528 | 8 | ↓ |
