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canSAR1647430
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NAMES
    SMILES
    COc1cc2oc(=O)c(CC(=O)NCCc3ccccc3)c(C)c2cc1Cl
    InChI
    InChI=1S/C21H20ClNO4/c1-13-15-10-17(22)19(26-2)12-18(15)27-21(25)16(13)11-20(24)23-9-8-14-6-4-3-5-7-14/h3-7,10,12H,8-9,11H2,1-2H3,(H,23,24)
    MOLECULAR FORMULA
    C21H20ClNO4
    CROSS REFERENCES
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    canSAR1647430

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.11
    AlogP 3.66
    HBond donors 1
    HBond acceptors 5
    Atoms 47
    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 canSAR1647430.