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canSAR114582
FEATURES
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NAMES
    SMILES
    Cc1cccc([C@@]2(O)C[C@H](C(=O)Nc3ccc(-n4ccccc4=O)cn3)N(C(=O)Nc3ccc(Cl)cc3)C2)c1
    InChI
    InChI=1S/C29H26ClN5O4/c1-19-5-4-6-20(15-19)29(39)16-24(35(18-29)28(38)32-22-10-8-21(30)9-11-22)27(37)33-25-13-12-23(17-31-25)34-14-3-2-7-26(34)36/h2-15,17,24,39H,16,18H2,1H3,(H,32,38)(H,31,33,37)/t24-,29-/m1/s1
    MOLECULAR FORMULA
    C29H26ClN5O4
    CROSS REFERENCES
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    canSAR114582

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 543.17
    AlogP 4.33
    HBond donors 3
    HBond acceptors 9
    Atoms 65
    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 canSAR114582.