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canSAR1687225
FEATURES
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NAMES
    SMILES
    C=C(C)[C@@H]1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
    InChI
    InChI=1S/C21H30O2/c1-5-6-7-8-16-12-19(22)21(20(23)13-16)18-11-15(4)9-10-17(18)14(2)3/h11-13,17-18,22-23H,2,5-10H2,1,3-4H3/t17-,18?/m0/s1
    MOLECULAR FORMULA
    C21H30O2
    CROSS REFERENCES
    1687225 logo

    canSAR1687225

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 314.22
    AlogP 5.85
    HBond donors 2
    HBond acceptors 2
    Atoms 53
    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 canSAR1687225.