In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2010 | 19 | Yes |
Popular Name: (1S,2R,4S)-2-[methyl-(1-methyl-4-piperidyl)amino]-4-propyl-cyclohexanol (1S,2R,4S)-2-[methyl-(1-methyl-4…
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) | 2.77 | 4.16 | -30.46 | 2 | 3 | 1 | 28 | 269.453 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 6.17 | -31.5 | 2 | 3 | 1 | 28 | 269.453 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.77 | 6.56 | -97.58 | 3 | 3 | 2 | 29 | 270.461 | 4 | ↓ |