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canSAR1267291
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NAMES
    SMILES
    C=CCc1cc(O)c(O)c(CN2CCC(CO)CC2)c1
    InChI
    InChI=1S/C16H23NO3/c1-2-3-13-8-14(16(20)15(19)9-13)10-17-6-4-12(11-18)5-7-17/h2,8-9,12,18-20H,1,3-7,10-11H2
    MOLECULAR FORMULA
    C16H23NO3
    CROSS REFERENCES
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    canSAR1267291

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 277.17
    AlogP 2.03
    HBond donors 3
    HBond acceptors 4
    Atoms 43
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1267291.