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canSAR393898
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NAMES
    SMILES
    COc1ccc(C[C@H](N)C(=O)N2Cc3ccccc3C[C@H]2c2nc(C)c(-c3ccccc3)[nH]2)cc1
    InChI
    InChI=1S/C29H30N4O2/c1-19-27(21-8-4-3-5-9-21)32-28(31-19)26-17-22-10-6-7-11-23(22)18-33(26)29(34)25(30)16-20-12-14-24(35-2)15-13-20/h3-15,25-26H,16-18,30H2,1-2H3,(H,31,32)/t25-,26-/m0/s1
    MOLECULAR FORMULA
    C29H30N4O2
    CROSS REFERENCES
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    canSAR393898

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 466.24
    AlogP 4.59
    HBond donors 3
    HBond acceptors 6
    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 canSAR393898.