| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 16 | Yes |
Popular Name: (1S,2R)-2-[(3S)-3-ethyl-1-piperidyl]cycloheptanamine (1S,2R)-2-[(3S)-3-ethyl-1-piperi…
| 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) | 2.76 | 6.57 | -119.8 | 4 | 2 | 2 | 32 | 226.408 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 7.05 | -30.92 | 3 | 2 | 1 | 30 | 225.4 | 2 | ↓ |
