In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 18th, 2011 | 24 | No |
Popular Name: N-hexyl-N-(2-morpholinoethyl)-1-oxido-pyridin-1-ium-3-carboxamide N-hexyl-N-(2-morpholinoethyl)-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) | 0.74 | 6.31 | -24.89 | 0 | 6 | 0 | 58 | 335.448 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.74 | 8.58 | -60.59 | 1 | 6 | 1 | 59 | 336.456 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.