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canSAR1767404
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NAMES
    SMILES
    C[C@]1(O)C[C@@H](c2nc(-c3cccc(Nc4ccccc4)c3)c3c(N)nccn32)C1
    InChI
    InChI=1S/C23H23N5O/c1-23(29)13-16(14-23)22-27-19(20-21(24)25-10-11-28(20)22)15-6-5-9-18(12-15)26-17-7-3-2-4-8-17/h2-12,16,26,29H,13-14H2,1H3,(H2,24,25)/t16-,23+
    MOLECULAR FORMULA
    C23H23N5O
    CROSS REFERENCES
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    canSAR1767404

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.19
    AlogP 4.35
    HBond donors 4
    HBond acceptors 6
    Atoms 52
    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 canSAR1767404.