| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 17 | Yes |
Popular Name: N'-[[5-(2-furyl)isoxazol-3-yl]methyl]-N,N'-dimethyl-ethane-1,2-diamine N'-[[5-(2-furyl)isoxazol-3-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) | 1.31 | 2.77 | -44.37 | 2 | 5 | 1 | 59 | 236.295 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 1.32 | -7.74 | 1 | 5 | 0 | 54 | 235.287 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.31 | 5.08 | -118.22 | 3 | 5 | 2 | 60 | 237.303 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
