| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 27th, 2011 | 19 | Yes |
Popular Name: 3-[(3,5-dimethylisoxazol-4-yl)methylamino]-5,6-dimethyl-pyridazine-4-carbonitrile 3-[(3,5-dimethylisoxazol-4-yl)me…
| 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) | 1.14 | 5.07 | -10.07 | 1 | 6 | 0 | 88 | 257.297 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.14 | 5.19 | -41.29 | 2 | 6 | 1 | 89 | 258.305 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
