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canSAR1531695
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NAMES
    SMILES
    Cc1c(C(=O)NCc2ccc3c(c2)OCO3)oc2ccc(Br)cc12
    InChI
    InChI=1S/C18H14BrNO4/c1-10-13-7-12(19)3-5-14(13)24-17(10)18(21)20-8-11-2-4-15-16(6-11)23-9-22-15/h2-7H,8-9H2,1H3,(H,20,21)
    MOLECULAR FORMULA
    C18H14BrNO4
    CROSS REFERENCES
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    canSAR1531695

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 387.01
    AlogP 4.16
    HBond donors 1
    HBond acceptors 5
    Atoms 38
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1531695.