In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 16 | Yes |
Popular Name: N-[[(3S)-3-ethyl-3-piperidyl]methyl]-N-methyl-cyclopentanamine 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) | 2.53 | 7.61 | -101.46 | 3 | 2 | 2 | 21 | 226.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.53 | 5.93 | -35.61 | 2 | 2 | 1 | 20 | 225.4 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.