| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 38 | Yes |
| 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) | 4.62 | 14.87 | -18.26 | 2 | 8 | 0 | 98 | 515.499 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.62 | 15.34 | -47.83 | 3 | 8 | 1 | 99 | 516.507 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.62 | 15.82 | -85.9 | 4 | 8 | 2 | 100 | 517.515 | 7 | ↓ |
