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canSAR463056
FEATURES
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NAMES
    SMILES
    C[C@H](N)C(=O)N1CCC(CC(=O)N2CCC([C@H]3c4ncc(Br)cc4CCc4cc(Cl)cc(Br)c43)CC2)CC1
    InChI
    InChI=1S/C29H35Br2ClN4O2/c1-17(33)29(38)36-8-4-18(5-9-36)12-25(37)35-10-6-19(7-11-35)27-26-20(14-23(32)15-24(26)31)2-3-21-13-22(30)16-34-28(21)27/h13-19,27H,2-12,33H2,1H3/t17-,27+/m0/s1
    MOLECULAR FORMULA
    C29H35Br2ClN4O2
    CROSS REFERENCES
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    canSAR463056

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 664.08
    AlogP 5.71
    HBond donors 2
    HBond acceptors 6
    Atoms 73
    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 canSAR463056.