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canSAR1686334
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NAMES
    SMILES
    COc1ccc(CCNC(=O)CCc2c(C)c3cc4c(C)coc4c(C)c3oc2=O)cc1OC
    InChI
    InChI=1S/C27H29NO6/c1-15-14-33-25-17(3)26-21(13-20(15)25)16(2)19(27(30)34-26)7-9-24(29)28-11-10-18-6-8-22(31-4)23(12-18)32-5/h6,8,12-14H,7,9-11H2,1-5H3,(H,28,29)
    MOLECULAR FORMULA
    C27H29NO6
    CROSS REFERENCES
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    canSAR1686334

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 463.20
    AlogP 4.77
    HBond donors 1
    HBond acceptors 7
    Atoms 63
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1686334.