In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 26 | No |
Popular Name: N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxamide N-[[2-(2-methylimidazol-1-yl)phe…
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) | 2.01 | 8.21 | -21.62 | 1 | 8 | 0 | 98 | 349.35 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 8.68 | -49.89 | 2 | 8 | 1 | 100 | 350.358 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.