| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 19 | No |
Popular Name: 1-[4-[methyl(pyridazin-3-yl)amino]-1-piperidyl]-2-methylsulfanyl-ethanone 1-[4-[methyl(pyridazin-3-yl)amin…
| 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) | 0.70 | 6.62 | -15.16 | 0 | 5 | 0 | 49 | 280.397 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.70 | 6.79 | -42.43 | 1 | 5 | 1 | 51 | 281.405 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.70 | 6.73 | -39.7 | 1 | 5 | 1 | 51 | 281.405 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
