| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 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) | 2.62 | 8.29 | -54.5 | 0 | 9 | -1 | 125 | 425.417 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.62 | 8.24 | -18.48 | 1 | 9 | 0 | 122 | 426.425 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 0.49 | -17.8 | 0 | 9 | 0 | 118 | 426.425 | 9 | ↓ |
