In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 20 | No |
Popular Name: N-cyclopropyl-1-oxido-N-(4-pyridylmethyl)pyridin-1-ium-2-carboxamide N-cyclopropyl-1-oxido-N-(4-pyrid…
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) | -0.73 | 6.47 | -20.8 | 0 | 5 | 0 | 59 | 269.304 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.73 | 6.93 | -49.74 | 1 | 5 | 1 | 60 | 270.312 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.