In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2008 | 34 | Yes |
Popular Name: N'-butyl-N-cyclooctyl-N'-methyl-4-oxo-1-[2-(2-pyridyl)ethyl]pyridine-3,5-dicarboxamide N'-butyl-N-cyclooctyl-N'-methyl-…
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) | 3.48 | 0.52 | -43.42 | 1 | 7 | 0 | 84 | 466.626 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.48 | 13.35 | -97.71 | 2 | 7 | 1 | 86 | 467.634 | 9 | ↓ |