| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2007 | 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) | 2.14 | 6.88 | -57.25 | 0 | 8 | -1 | 95 | 464.542 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.59 | 8.45 | -46.34 | 2 | 8 | 1 | 93 | 466.558 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.14 | 9.22 | -76.7 | 1 | 8 | 0 | 96 | 465.55 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.59 | 8.73 | -121.99 | 3 | 8 | 2 | 95 | 467.566 | 8 | ↓ |
