In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 18 | Yes |
Popular Name: (1S,2R,4R)-2-[(3S)-3-ethoxy-1-piperidyl]-N,4-dimethyl-cyclohexanamine (1S,2R,4R)-2-[(3S)-3-ethoxy-1-pi…
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 | 5.79 | -34.35 | 2 | 3 | 1 | 29 | 255.426 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 6.81 | -32.29 | 2 | 3 | 1 | 26 | 255.426 | 4 | ↓ |