| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2011 | 29 | No |
Popular Name: 6-(4-isobutylphenyl)-2-(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4,5-dihydropyridazin-3-one 6-(4-isobutylphenyl)-2-(4-phenyl…
| 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) | 4.40 | 15.36 | -65.41 | 0 | 6 | -1 | 63 | 404.519 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.67 | 15.89 | -17.63 | 1 | 6 | 0 | 66 | 405.527 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
