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canSAR1636984
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NAMES
    SMILES
    Cc1cccnc1C(NC(=O)C1CCN(Cc2ccc3ccccc3n2)CC1)c1ccc(Cl)cc1
    InChI
    InChI=1S/C29H29ClN4O/c1-20-5-4-16-31-27(20)28(22-8-11-24(30)12-9-22)33-29(35)23-14-17-34(18-15-23)19-25-13-10-21-6-2-3-7-26(21)32-25/h2-13,16,23,28H,14-15,17-19H2,1H3,(H,33,35)
    MOLECULAR FORMULA
    C29H29ClN4O
    CROSS REFERENCES
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    canSAR1636984

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 484.20
    AlogP 5.71
    HBond donors 1
    HBond acceptors 5
    Atoms 64
    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 canSAR1636984.