| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2009 | 42 | 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) | 8.61 | 13.76 | -48.31 | 2 | 5 | -1 | 98 | 573.794 | 11 | ↓ |
| Mid Mid (pH 6-8) | 8.61 | 14.42 | -118.57 | 1 | 5 | -2 | 100 | 572.786 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 8.61 | 12.87 | -12.53 | 3 | 5 | 0 | 95 | 574.802 | 11 | ↓ |
