| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 17 | Yes |
Popular Name: N-[[(2S,3S)-2-(2-furyl)-1-methyl-azepan-3-yl]methyl]ethanamine N-[[(2S,3S)-2-(2-furyl)-1-methyl…
| 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) | 2.27 | 7.61 | -94.68 | 3 | 3 | 2 | 34 | 238.375 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 5.64 | -38.08 | 2 | 3 | 1 | 33 | 237.367 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
