| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 21 | Yes |
Popular Name: N-[[5-[[(3S)-3-propoxy-1-piperidyl]methyl]isoxazol-3-yl]methyl]propan-2-amine N-[[5-[[(3S)-3-propoxy-1-piperid…
| 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) | 2.19 | 7.45 | -98.11 | 3 | 5 | 2 | 56 | 297.443 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.19 | 6.25 | -42.1 | 2 | 5 | 1 | 52 | 296.435 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
