In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 28th, 2005 | 24 | Yes |
Popular Name: ethyl 2-methyl-4-(4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate ethyl 2-methyl-4-(4-methylphenyl…
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) | 4.25 | 1.39 | -14.16 | 0 | 4 | 0 | 55 | 325.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 3.91 | -8.62 | 0 | 4 | 0 | 55 | 325.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.42 | 5.59 | -18.57 | 0 | 4 | 0 | 55 | 325.408 | 4 | ↓ |