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canSAR112651
FEATURES
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NAMES
    SMILES
    COc1cc2c(cc1OC)C(=O)/C(=C/c1cc(C)c(OCC(=O)O)c(C)c1)C2
    InChI
    InChI=1S/C22H22O6/c1-12-5-14(6-13(2)22(12)28-11-20(23)24)7-16-8-15-9-18(26-3)19(27-4)10-17(15)21(16)25/h5-7,9-10H,8,11H2,1-4H3,(H,23,24)/b16-7+
    MOLECULAR FORMULA
    C22H22O6
    CROSS REFERENCES
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    canSAR112651

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 382.14
    AlogP 3.61
    HBond donors 1
    HBond acceptors 6
    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 canSAR112651.