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canSAR839610
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NAMES
    SMILES
    CC#CCOc1cccc2c1-c1cccc3c1[C@@H](C2)N(CCC)CC3
    InChI
    InChI=1S/C23H25NO/c1-3-5-15-25-21-11-7-9-18-16-20-22-17(12-14-24(20)13-4-2)8-6-10-19(22)23(18)21/h6-11,20H,4,12-16H2,1-2H3/t20-/m1/s1
    MOLECULAR FORMULA
    C23H25NO
    CROSS REFERENCES
    839610 logo

    canSAR839610

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.19
    AlogP 4.62
    HBond donors 0
    HBond acceptors 2
    Atoms 50
    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 canSAR839610.