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canSAR2021300
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NAMES
    SMILES
    COCCN(CC(=O)Nc1cccc(C)c1C)C(=O)c1cc(-c2ccncc2)nc2ccccc12
    InChI
    InChI=1S/C28H28N4O3/c1-19-7-6-10-24(20(19)2)31-27(33)18-32(15-16-35-3)28(34)23-17-26(21-11-13-29-14-12-21)30-25-9-5-4-8-22(23)25/h4-14,17H,15-16,18H2,1-3H3,(H,31,33)
    MOLECULAR FORMULA
    C28H28N4O3
    CROSS REFERENCES
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    canSAR2021300

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.22
    AlogP 4.64
    HBond donors 1
    HBond acceptors 7
    Atoms 63
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2021300.