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canSAR566049
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NAMES
    SMILES
    CC(=O)Nc1ccc(CCNC(C)Cc2ccc(C(=O)Nc3ccc(CC(C)NCCc4cccc(Cl)c4)cc3)cc2)cc1
    InChI
    InChI=1S/C37H43ClN4O2/c1-26(39-21-19-29-9-15-35(16-10-29)41-28(3)43)23-31-7-13-33(14-8-31)37(44)42-36-17-11-32(12-18-36)24-27(2)40-22-20-30-5-4-6-34(38)25-30/h4-18,25-27,39-40H,19-24H2,1-3H3,(H,41,43)(H,42,44)
    MOLECULAR FORMULA
    C37H43ClN4O2
    CROSS REFERENCES
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    canSAR566049

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 610.31
    AlogP 7.08
    HBond donors 4
    HBond acceptors 6
    Atoms 87
    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 canSAR566049.