| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2010 | 23 | No |
Popular Name: N-[2-(3,5-dimethylpyrazol-1-yl)phenyl]-1-oxido-pyridin-1-ium-2-carboxamide N-[2-(3,5-dimethylpyrazol-1-yl)p…
| 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) | 0.57 | 9.22 | -34.2 | 1 | 6 | 0 | 72 | 308.341 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.64 | 7.69 | -82.12 | 0 | 6 | -1 | 79 | 307.333 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
