| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 16 | Yes |
Popular Name: N-[[5-(2-furyl)isoxazol-3-yl]methyl]-N-methyl-ethane-1,2-diamine N-[[5-(2-furyl)isoxazol-3-yl]met…
| 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) | 0.33 | 0.89 | -49.05 | 3 | 5 | 1 | 70 | 222.268 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.33 | 3.22 | -122.45 | 4 | 5 | 2 | 71 | 223.276 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
