| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 18 | Yes |
Popular Name: 1-[4-(5-aminoisoxazol-3-yl)-1-piperidyl]-2,2-dimethyl-propan-1-one 1-[4-(5-aminoisoxazol-3-yl)-1-pi…
| 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) | 1.69 | 2.53 | -11.44 | 2 | 5 | 0 | 72 | 251.33 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.69 | 2.6 | -38.3 | 3 | 5 | 1 | 74 | 252.338 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
