| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 33 | 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) | 1.65 | 7.94 | -48.82 | 2 | 8 | 1 | 93 | 452.531 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.07 | 8.63 | -57.52 | 1 | 8 | 1 | 90 | 452.531 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.10 | 7.91 | -123.9 | 3 | 8 | 2 | 95 | 453.539 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.07 | 8.91 | -124.52 | 2 | 8 | 2 | 91 | 453.539 | 9 | ↓ |
