In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 18 | Yes |
Popular Name: N-[[(3S)-3-ethyl-3-piperidyl]methyl]-N-[[(2S)-tetrahydrofuran-2-yl]methyl]ethanamine N-[[(3S)-3-ethyl-3-piperidyl]met…
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) | 1.88 | 5.1 | -37.71 | 2 | 3 | 1 | 29 | 255.426 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 6.81 | -93.32 | 3 | 3 | 2 | 30 | 256.434 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.