| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2007 | 39 | 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) | 5.69 | 15.22 | -75.07 | 1 | 7 | 0 | 83 | 528.649 | 11 | ↓ |
| Hi High (pH 8-9.5) | 5.69 | 12.7 | -57.96 | 0 | 7 | -1 | 82 | 527.641 | 11 | ↓ |
| Mid Mid (pH 6-8) | 5.11 | 2.31 | -53.24 | 1 | 7 | 1 | 77 | 529.657 | 11 | ↓ |
