| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 20 | No |
Popular Name: 5,6-dimethyl-3-[2-(1-piperidyl)ethylamino]pyridazine-4-carbothioamide 5,6-dimethyl-3-[2-(1-piperidyl)e…
| 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) | 1.87 | 5.78 | -44.16 | 4 | 5 | 1 | 68 | 294.448 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 3.58 | -12.76 | 3 | 5 | 0 | 67 | 293.44 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.87 | 5.92 | -98.92 | 5 | 5 | 2 | 70 | 295.456 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
