| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 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) | 5.20 | 11.34 | -55.58 | 0 | 7 | -1 | 96 | 493.948 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.61 | 12.74 | -11.8 | 0 | 7 | 0 | 90 | 494.956 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.20 | 12.16 | -12.47 | 1 | 7 | 0 | 93 | 494.956 | 6 | ↓ |
