| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2009 | 34 | 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) | 3.23 | 7.89 | -59.41 | 0 | 8 | -1 | 95 | 467.542 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 10.23 | -73.56 | 1 | 8 | 0 | 96 | 468.55 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.23 | 9.41 | -53.2 | 2 | 8 | 1 | 94 | 469.558 | 10 | ↓ |
