| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2009 | 35 | 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) | 4.42 | 9.15 | -60.19 | 0 | 7 | -1 | 82 | 497.637 | 12 | ↓ |
| Mid Mid (pH 6-8) | 4.42 | 11.47 | -74.04 | 1 | 7 | 0 | 83 | 498.645 | 12 | ↓ |
| Lo Low (pH 4.5-6) | 4.42 | 10.65 | -50.24 | 2 | 7 | 1 | 81 | 499.653 | 12 | ↓ |
