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canSAR673831
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NAMES
    SMILES
    COc1ccc(/C=C/C(=O)c2cccc(OCc3cn(CC(O)CN4C(=O)C(=O)c5cc(Cl)ccc54)nn3)c2)c(OC)c1OC
    InChI
    InChI=1S/C32H29ClN4O8/c1-42-28-12-8-19(30(43-2)31(28)44-3)7-11-27(39)20-5-4-6-24(13-20)45-18-22-15-36(35-34-22)16-23(38)17-37-26-10-9-21(33)14-25(26)29(40)32(37)41/h4-15,23,38H,16-18H2,1-3H3/b11-7+
    MOLECULAR FORMULA
    C32H29ClN4O8
    CROSS REFERENCES
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    canSAR673831

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 632.17
    AlogP 4.02
    HBond donors 1
    HBond acceptors 12
    Atoms 74
    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 canSAR673831.