canSAR544906
FEATURES
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NAMES
    SMILES
    CC[n+]1ccc(CCC(=O)c2cc3cc(OC)c(OC)cc3s2)cc1
    InChI
    InChI=1S/C20H22NO3S/c1-4-21-9-7-14(8-10-21)5-6-16(22)20-12-15-11-17(23-2)18(24-3)13-19(15)25-20/h7-13H,4-6H2,1-3H3/q+1
    MOLECULAR FORMULA
    C20H22NO3S+
    CROSS REFERENCES
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    canSAR544906
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight356.13
    AlogP4.04
    HBond donors0
    HBond acceptors4
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR544906.