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canSAR1519848
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NAMES
    SMILES
    Cc1cccc(C)c1-c1cc(C)c2nc(Nc3cccc(C(=O)NCCCN4CCN(C)CC4)c3)nnc2c1
    InChI
    InChI=1S/C31H37N7O/c1-21-8-5-9-22(2)28(21)25-18-23(3)29-27(20-25)35-36-31(34-29)33-26-11-6-10-24(19-26)30(39)32-12-7-13-38-16-14-37(4)15-17-38/h5-6,8-11,18-20H,7,12-17H2,1-4H3,(H,32,39)(H,33,34,36)
    MOLECULAR FORMULA
    C31H37N7O
    CROSS REFERENCES
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    canSAR1519848

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 523.31
    AlogP 4.73
    HBond donors 2
    HBond acceptors 8
    Atoms 76
    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 canSAR1519848.