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canSAR559643
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NAMES
    SMILES
    CC(CO)(CO)NCc1ccc2cccc3c2c1-c1ccccc1-3
    InChI
    InChI=1S/C21H21NO2/c1-21(12-23,13-24)22-11-15-10-9-14-5-4-8-18-16-6-2-3-7-17(16)20(15)19(14)18/h2-10,22-24H,11-13H2,1H3
    MOLECULAR FORMULA
    C21H21NO2
    CROSS REFERENCES
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    canSAR559643

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 319.16
    AlogP 3.32
    HBond donors 3
    HBond acceptors 3
    Atoms 45
    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 canSAR559643.