In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 17 | Yes |
Popular Name: (2R)-2-[(3R,5S)-3,5-dimethyl-1-piperidyl]-2-phenyl-ethanamine (2R)-2-[(3R,5S)-3,5-dimethyl-1-p…
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) | 2.35 | 7.39 | -117.54 | 4 | 2 | 2 | 32 | 234.387 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.35 | 7.33 | -29.37 | 3 | 2 | 1 | 30 | 233.379 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.35 | 5.68 | -47.54 | 3 | 2 | 1 | 31 | 233.379 | 3 | ↓ |