In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | Yes |
Popular Name: 1-[(1S,2R)-2-(ethylamino)-1-methyl-2-phenyl-ethyl]-N,N-dimethyl-piperidin-4-amine 1-[(1S,2R)-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 | 8.42 | -83.21 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 8.58 | -94.97 | 3 | 3 | 2 | 21 | 291.483 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 7.87 | -114.08 | 3 | 3 | 2 | 24 | 291.483 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 5.97 | -31.17 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 7.34 | -33.92 | 2 | 3 | 1 | 20 | 290.475 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.84 | 10.48 | -201.66 | 4 | 3 | 3 | 25 | 292.491 | 6 | ↓ |