| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2008 | 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) | 3.43 | 5.79 | -11.23 | 0 | 7 | 0 | 64 | 450.535 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.43 | 8.05 | -48.57 | 1 | 7 | 1 | 66 | 451.543 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.43 | 10.91 | -126.74 | 2 | 7 | 2 | 67 | 452.551 | 6 | ↓ |