| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2007 | 31 | Yes |
| 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) | 3.30 | 3.72 | -18.03 | 3 | 8 | 0 | 108 | 488.338 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 3.03 | -52.35 | 1 | 8 | -1 | 107 | 487.33 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.30 | 4.48 | -56.37 | 2 | 8 | -1 | 111 | 487.33 | 7 | ↓ |
