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canSAR351118
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NAMES
    SMILES
    COc1ccc(C2Sc3ccccc3-n3c(CN4CCOCC4)ccc32)c(OC)c1
    InChI
    InChI=1S/C24H26N2O3S/c1-27-18-8-9-19(22(15-18)28-2)24-21-10-7-17(16-25-11-13-29-14-12-25)26(21)20-5-3-4-6-23(20)30-24/h3-10,15,24H,11-14,16H2,1-2H3
    MOLECULAR FORMULA
    C24H26N2O3S
    CROSS REFERENCES
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    canSAR351118

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 422.17
    AlogP 4.52
    HBond donors 0
    HBond acceptors 5
    Atoms 56
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR351118.