| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 2007 | 33 | 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) | 4.92 | 12.06 | -52.66 | 0 | 8 | -1 | 119 | 476.515 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.33 | 12.28 | -12.95 | 0 | 8 | 0 | 113 | 477.523 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.36 | 11.94 | -20.42 | 1 | 8 | 0 | 116 | 477.523 | 4 | ↓ |
