In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 16 | No |
Popular Name: 2-(azetidin-3-yloxy)-5-nitro-pyridine-3-carbonitrile 2-(azetidin-3-yloxy)-5-nitro-pyr…
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) | 0.54 | 2.07 | -47.02 | 2 | 7 | 1 | 108 | 221.196 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.54 | 0.37 | -8.39 | 1 | 7 | 0 | 104 | 220.188 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.