| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 18th, 2010 | 44 | 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) | 5.87 | 7.47 | -63.22 | 5 | 8 | 1 | 107 | 586.716 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.21 | 8.47 | -96.54 | 4 | 8 | 0 | 110 | 585.708 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.21 | 7.91 | -65.09 | 5 | 8 | 1 | 107 | 586.716 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.87 | 6.8 | -62.73 | 5 | 8 | 1 | 107 | 586.716 | 6 | ↓ |
