canSAR542121
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCCCOc1cc(CN(C(C)=O)c2cccc(C[n+]3csc(C)c3)c2)ccc1C
    InChI
    InChI=1S/C35H51N2O2S/c1-5-6-7-8-9-10-11-12-13-14-15-16-22-39-35-24-33(21-20-29(35)2)27-37(31(4)38)34-19-17-18-32(23-34)26-36-25-30(3)40-28-36/h17-21,23-25,28H,5-16,22,26-27H2,1-4H3/q+1
    MOLECULAR FORMULA
    C35H51N2O2S+
    CROSS REFERENCES
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    canSAR542121
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight563.37
    AlogP9.33
    HBond donors0
    HBond acceptors4
    Atoms91
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR542121.