| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 29 | 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) | 0.73 | 1.1 | -56.81 | 2 | 9 | -1 | 133 | 391.363 | 5 | ↓ |
| Ref Reference (pH 7) | 0.73 | 1.34 | -55.93 | 2 | 9 | -1 | 133 | 391.363 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.73 | 1.27 | -56.07 | 2 | 9 | -1 | 133 | 391.363 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.73 | 1.27 | -55.84 | 2 | 9 | -1 | 133 | 391.363 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.27 | 3.82 | -17.77 | 3 | 9 | 0 | 130 | 392.371 | 5 | ↓ |
