In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: 1-[(1S,2S)-2-(ethylamino)-1-methyl-2-phenyl-ethyl]-N,N-dimethyl-piperidin-4-amine 1-[(1S,2S)-2-(ethylamino)-1-meth…
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) | 2.84 | 8.62 | -87.89 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 7.69 | -111.37 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 6.92 | -30.27 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 9.53 | -96.36 | 3 | 3 | 2 | 21 | 291.483 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 7.06 | -32.85 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |