| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2008 | 31 | 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) | 3.06 | 6.58 | -62.42 | 1 | 7 | -1 | 99 | 424.473 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 6.5 | -12.11 | 2 | 7 | 0 | 96 | 425.481 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.48 | 6.85 | -10.67 | 1 | 7 | 0 | 93 | 425.481 | 9 | ↓ |
