| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 22 | Yes |
Popular Name: 3-isobutoxy-1-[4-(pyridazin-3-ylamino)-1-piperidyl]propan-1-one 3-isobutoxy-1-[4-(pyridazin-3-yl…
| 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) | 1.31 | 5.89 | -13.73 | 1 | 6 | 0 | 67 | 306.41 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 6.07 | -38.13 | 2 | 6 | 1 | 69 | 307.418 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 6.06 | -40.33 | 2 | 6 | 1 | 69 | 307.418 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
