| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 16 | Yes |
Popular Name: N-[[(2S)-1-[[(3S)-tetrahydrofuran-3-yl]methyl]-2-piperidyl]methyl]ethanamine N-[[(2S)-1-[[(3S)-tetrahydrofura…
| 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) | 1.53 | 6.16 | -116.57 | 3 | 3 | 2 | 30 | 228.38 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.53 | 5.82 | -30.84 | 2 | 3 | 1 | 26 | 227.372 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.53 | 4.29 | -38.46 | 2 | 3 | 1 | 29 | 227.372 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
