| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 3rd, 2011 | 15 | Yes |
Popular Name: 4-(2-chloro-4-fluoro-phenyl)-3-methyl-isoxazol-5-amine 4-(2-chloro-4-fluoro-phenyl)-3-m…
| 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) | 2.74 | 3.34 | -6.57 | 2 | 3 | 0 | 52 | 226.638 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.74 | 3.26 | -30.25 | 3 | 3 | 1 | 53 | 227.646 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
