In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2005 | 31 | No |
Popular Name: butyl 2,7,7-trimethyl-4-(1-naphthyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate butyl 2,7,7-trimethyl-4-(1-napht…
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) | 6.21 | 1.69 | -8.08 | 0 | 4 | 0 | 55 | 417.549 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.39 | 0.42 | -9.33 | 0 | 4 | 0 | 55 | 417.549 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.21 | 1.31 | -11.32 | 0 | 4 | 0 | 55 | 417.549 | 6 | ↓ |