In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2010 | 27 | Yes |
Popular Name: (2R)-1-[4-[(1R)-1-fluoroethyl]phenyl]sulfonyl-2-methyl-4-[2-(4-pyridyl)ethyl]piperazine (2R)-1-[4-[(1R)-1-fluoroethyl]ph…
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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) | 2.62 | 6.77 | -11.91 | 0 | 5 | 0 | 54 | 391.512 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 9 | -56.6 | 1 | 5 | 1 | 55 | 392.52 | 6 | ↓ |