In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2011 | 21 | Yes |
Popular Name: (2S)-6-[4-(dimethylamino)-1-piperidyl]-2-methyl-2-(propylamino)hexan-1-ol (2S)-6-[4-(dimethylamino)-1-pipe…
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) | 2.27 | 4.44 | -85.74 | 4 | 4 | 2 | 45 | 301.519 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 4.81 | -73.92 | 4 | 4 | 2 | 45 | 301.519 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 7.05 | -157.77 | 5 | 4 | 3 | 46 | 302.527 | 10 | ↓ |