| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 7th, 2007 | 38 | 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) | 3.73 | 4.12 | -55.85 | 3 | 9 | -1 | 152 | 548.362 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.63 | 2.48 | -102.02 | 2 | 9 | -2 | 155 | 547.354 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 5.94 | -18.82 | 4 | 9 | 0 | 149 | 549.37 | 6 | ↓ |
