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canSAR660078
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NAMES
    SMILES
    COc1cc(OC)cc(/C(C)=C2\C(=O)N(Cc3ccncc3)C(=O)\C2=C\c2ccccc2)c1.Cl
    InChI
    InChI=1S/C27H24N2O4.ClH/c1-18(21-14-22(32-2)16-23(15-21)33-3)25-24(13-19-7-5-4-6-8-19)26(30)29(27(25)31)17-20-9-11-28-12-10-20;/h4-16H,17H2,1-3H3;1H/b24-13+,25-18-;
    MOLECULAR FORMULA
    C27H25ClN2O4
    CROSS REFERENCES
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    canSAR660078

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 476.15
    AlogP 4.95
    HBond donors 0
    HBond acceptors 6
    Atoms 59
    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 canSAR660078.