| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2011 | 22 | Yes |
Popular Name: 4-[(3,5-dimethylisoxazol-4-yl)methyl]-N-(2,2,2-trifluoroethyl)piperazine-1-carboxamide 4-[(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) | 1.62 | 3.17 | -12.32 | 1 | 6 | 0 | 62 | 320.315 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.62 | 5.38 | -55.37 | 2 | 6 | 1 | 63 | 321.323 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
