| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2005 | 29 | No |
Popular Name: CC(=O)C1=C(C(=O)N([C@@H]1c2ccc(cc2OC)OC)c3cccc(c3)C(=O)O)O CC(=O)C1=C(C(=O)N([C@@H]1c2ccc(c…
| 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) | 2.40 | 0.94 | -71.21 | 1 | 8 | -1 | 116 | 396.375 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 0.83 | -84.62 | 0 | 8 | -1 | 113 | 396.375 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | 0.57 | -89.92 | 1 | 8 | -1 | 116 | 396.375 | 5 | ↓ |
