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canSAR186316
FEATURES
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NAMES
    SMILES
    CCC(Cc1cnc2nc(N)nc(N)c2n1)(C(=O)OC)c1ccc(C(=O)NC(CCCNC(=O)c2ccccc2C(=O)O)C(=O)O)cc1
    InChI
    InChI=1S/C32H34N8O8/c1-3-32(30(47)48-2,15-19-16-36-25-23(37-19)24(33)39-31(34)40-25)18-12-10-17(11-13-18)26(41)38-22(29(45)46)9-6-14-35-27(42)20-7-4-5-8-21(20)28(43)44/h4-5,7-8,10-13,16,22H,3,6,9,14-15H2,1-2H3,(H,35,42)(H,38,41)(H,43,44)(H,45,46)(H4,33,34,36,39,40)
    MOLECULAR FORMULA
    C32H34N8O8
    CROSS REFERENCES
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    canSAR186316

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 658.25
    AlogP 1.74
    HBond donors 8
    HBond acceptors 16
    Atoms 82
    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 canSAR186316.