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canSAR1687507
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NAMES
    SMILES
    O=C(NCCC(=O)N(Cc1ccco1)Cc1cccs1)c1ccc(Br)cc1
    InChI
    InChI=1S/C20H19BrN2O3S/c21-16-7-5-15(6-8-16)20(25)22-10-9-19(24)23(13-17-3-1-11-26-17)14-18-4-2-12-27-18/h1-8,11-12H,9-10,13-14H2,(H,22,25)
    MOLECULAR FORMULA
    C20H19BrN2O3S
    CROSS REFERENCES
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    canSAR1687507

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.03
    AlogP 4.45
    HBond donors 1
    HBond acceptors 5
    Atoms 46
    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 canSAR1687507.