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canSAR1727766
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NAMES
    SMILES
    COC1CC2C=C(C)C=CC=CC(=O)NC(c3ccccc3)CC=CCCC(O)CC(O)=C2C1=O
    InChI
    InChI=1S/C29H35NO5/c1-20-11-9-10-16-27(33)30-24(21-12-5-3-6-13-21)15-8-4-7-14-23(31)19-25(32)28-22(17-20)18-26(35-2)29(28)34/h3-6,8-13,16-17,22-24,26,31-32H,7,14-15,18-19H2,1-2H3,(H,30,33)
    MOLECULAR FORMULA
    C29H35NO5
    CROSS REFERENCES
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    canSAR1727766

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 477.25
    AlogP 4.81
    HBond donors 3
    HBond acceptors 6
    Atoms 70
    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 canSAR1727766.