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canSAR1495063
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NAMES
    SMILES
    Cc1ccc(-c2c[nH]c(C3(NCCC(C)(C)C)CCCC3)n2)cc1
    InChI
    InChI=1S/C21H31N3/c1-16-7-9-17(10-8-16)18-15-22-19(24-18)21(11-5-6-12-21)23-14-13-20(2,3)4/h7-10,15,23H,5-6,11-14H2,1-4H3,(H,22,24)
    MOLECULAR FORMULA
    C21H31N3
    CROSS REFERENCES
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    canSAR1495063

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 325.25
    AlogP 5.18
    HBond donors 2
    HBond acceptors 3
    Atoms 55
    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 canSAR1495063.