| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 19 | Yes |
Popular Name: 1-[6-(4-isobutylpiperazin-1-yl)pyridazin-3-yl]-N-methyl-methanamine 1-[6-(4-isobutylpiperazin-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) | 1.27 | 6.97 | -87.84 | 3 | 5 | 2 | 50 | 265.405 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 5.51 | -42.29 | 2 | 5 | 1 | 45 | 264.397 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 3.67 | -8.32 | 1 | 5 | 0 | 44 | 263.389 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 5.02 | -41.36 | 2 | 5 | 1 | 49 | 264.397 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
