In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: N,N-dimethyl-2-[4-[[(1S,2S)-2-methylcyclohexyl]methylamino]-1-piperidyl]acetamide N,N-dimethyl-2-[4-[[(1S,2S)-2-me…
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) | 1.96 | 7.4 | -37.25 | 2 | 4 | 1 | 37 | 296.479 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 6.4 | -43.22 | 2 | 4 | 1 | 40 | 296.479 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 8.57 | -111.37 | 3 | 4 | 2 | 41 | 297.487 | 5 | ↓ |