| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 19 | Yes |
Popular Name: N-[[5-(indolin-1-ylmethyl)isoxazol-3-yl]methyl]ethanamine N-[[5-(indolin-1-ylmethyl)isoxaz…
| 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) | 2.33 | 7.4 | -45.31 | 2 | 4 | 1 | 46 | 258.345 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 6.02 | -8.22 | 1 | 4 | 0 | 41 | 257.337 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
