In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (1S,2R,4R)-4-ethyl-N-methyl-2-[(3R)-3-propoxy-1-piperidyl]cyclohexanamine (1S,2R,4R)-4-ethyl-N-methyl-2-[(…
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) | 3.46 | 7.22 | -36.43 | 2 | 3 | 1 | 29 | 283.48 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.46 | 8.24 | -32.39 | 2 | 3 | 1 | 26 | 283.48 | 6 | ↓ |