| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2007 | 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) | 4.76 | 11.58 | -26.38 | 1 | 5 | 0 | 60 | 416.531 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.82 | -2.55 | -45.53 | 1 | 5 | 1 | 59 | 417.539 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.82 | 11.73 | -37.06 | 2 | 5 | 1 | 65 | 417.539 | 5 | ↓ |
