| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 2007 | 35 | 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) | 3.65 | 10.81 | -57.31 | 0 | 7 | -1 | 92 | 469.517 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 10.24 | -13.39 | 0 | 7 | 0 | 86 | 470.525 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.10 | 10.26 | -14.7 | 1 | 7 | 0 | 89 | 470.525 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.10 | 10.54 | -40.35 | 2 | 7 | 1 | 90 | 471.533 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | 10.51 | -45.54 | 1 | 7 | 1 | 87 | 471.533 | 10 | ↓ |
