In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 17 | Yes |
Popular Name: (1S,2R)-2-(4-ethyl-1-piperidyl)-N-methyl-cycloheptanamine (1S,2R)-2-(4-ethyl-1-piperidyl)-…
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) | 3.85 | 8.87 | -111.4 | 3 | 2 | 2 | 21 | 240.435 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.85 | 7.58 | -30.48 | 2 | 2 | 1 | 16 | 239.427 | 3 | ↓ |