In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 20 | No |
Popular Name: N-[(1R)-1-(4-methylsulfanylphenyl)ethyl]-1-oxido-pyridin-1-ium-2-carboxamide N-[(1R)-1-(4-methylsulfanylpheny…
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) | 0.94 | 8.64 | -33.57 | 1 | 4 | 0 | 55 | 288.372 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.