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canSAR643714
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NAMES
    SMILES
    CCN(CCCl)c1cc(CN(C)C)cc(NC(=O)c2ccc(C(=O)Nc3ccccc3)cc2)c1
    InChI
    InChI=1S/C27H31ClN4O2/c1-4-32(15-14-28)25-17-20(19-31(2)3)16-24(18-25)30-27(34)22-12-10-21(11-13-22)26(33)29-23-8-6-5-7-9-23/h5-13,16-18H,4,14-15,19H2,1-3H3,(H,29,33)(H,30,34)
    MOLECULAR FORMULA
    C27H31ClN4O2
    CROSS REFERENCES
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    canSAR643714

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 478.21
    AlogP 5.32
    HBond donors 2
    HBond acceptors 6
    Atoms 65
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR643714.