In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2005 | 33 | Yes |
Popular Name: N,N-dihexyl-2-oxo-1-(3-pyridylmethyl)quinoline-3-carboxamide N,N-dihexyl-2-oxo-1-(3-pyridylme…
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) | 5.83 | 2.05 | -20.95 | 0 | 5 | 0 | 55 | 447.623 | 13 | ↓ |
Lo Low (pH 4.5-6) | 5.83 | 2.16 | -45.99 | 1 | 5 | 1 | 56 | 448.631 | 13 | ↓ |