In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2010 | 21 | Yes |
Popular Name: (1S,2R,4S)-2-[4-(dimethylamino)-1-piperidyl]-4-(1,1-dimethylpropyl)cyclohexanol (1S,2R,4S)-2-[4-(dimethylamino)-…
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) | 3.19 | 6.03 | -29.88 | 2 | 3 | 1 | 28 | 297.507 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.19 | 8.64 | -94.76 | 3 | 3 | 2 | 29 | 298.515 | 4 | ↓ |