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canSAR1431520
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NAMES
    SMILES
    COc1ccc(C(c2sc3ncnn3c2O)N2CC(C)OC(C)C2)cc1OC
    InChI
    InChI=1S/C19H24N4O4S/c1-11-8-22(9-12(2)27-11)16(13-5-6-14(25-3)15(7-13)26-4)17-18(24)23-19(28-17)20-10-21-23/h5-7,10-12,16,24H,8-9H2,1-4H3
    MOLECULAR FORMULA
    C19H24N4O4S
    CROSS REFERENCES
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    canSAR1431520

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.15
    AlogP 2.71
    HBond donors 1
    HBond acceptors 8
    Atoms 52
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1431520.