| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2010 | 37 | No |
None
| 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) | 4.94 | 12.98 | -48.08 | 3 | 7 | 1 | 78 | 557.165 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.94 | 12.88 | -51.97 | 3 | 7 | 1 | 78 | 557.165 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.94 | 10.6 | -13.34 | 2 | 7 | 0 | 77 | 556.157 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.94 | 13.45 | -88.34 | 4 | 7 | 2 | 79 | 558.173 | 9 | ↓ |
