In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 23 | Yes |
Popular Name: (3R)-1-[1-(benzothiophen-2-yl)cyclohexyl]-3-(fluoromethyl)piperidin-1-ium (3R)-1-[1-(benzothiophen-2-yl)cy…
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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) | 6.19 | 12.69 | -31.82 | 1 | 1 | 1 | 4 | 332.508 | 3 | ↓ |
Mid Mid (pH 6-8) | 6.19 | 11.46 | -3.8 | 0 | 1 | 0 | 3 | 331.5 | 3 | ↓ |