In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2010 | 20 | No |
Popular Name: N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]-1-oxido-pyridin-1-ium-3-carboxamide N-[2-[(2S,6R)-2,6-dimethylmorpho…
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) | -0.75 | 2.19 | -27.6 | 1 | 6 | 0 | 67 | 279.34 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.75 | 4.47 | -70.95 | 2 | 6 | 1 | 68 | 280.348 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.