| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 37 | Yes |
Popular Name: 2-butyl-3-[4-(2-carboxylatophenyl)benzyl]-6-keto-cyclohepta[d]imidazole-5,7-dicarboxylate 2-butyl-3-[4-(2-carboxylatopheny…
| 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) | 4.74 | 17.54 | -216.48 | 0 | 9 | -3 | 155 | 497.483 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.74 | 1.31 | -190.87 | 1 | 9 | -2 | 152 | 498.491 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.74 | 17.78 | -185.58 | 1 | 9 | -2 | 157 | 498.491 | 9 | ↓ |
