| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2005 | 25 | Yes |
Popular Name: butyl 2-methyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate butyl 2-methyl-5-oxo-4-phenyl-1,…
| 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) | 4.87 | 1.18 | -13.65 | 0 | 4 | 0 | 55 | 339.435 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.87 | 3.91 | -9.2 | 0 | 4 | 0 | 55 | 339.435 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.03 | 4.23 | -22.03 | 0 | 4 | 0 | 55 | 339.435 | 6 | ↓ |
