| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2011 | 18 | Yes |
Popular Name: 3-(5-fluoro-2-methyl-phenyl)-4-isobutyl-isoxazol-5-amine 3-(5-fluoro-2-methyl-phenyl)-4-i…
| 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) | 3.47 | 5.44 | -6.97 | 2 | 3 | 0 | 52 | 248.301 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.47 | 4.81 | -28.11 | 3 | 3 | 1 | 53 | 249.309 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
