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canSAR653299
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NAMES
    SMILES
    COc1ccc(C/C(=N/P(=O)(Oc2ccccc2)Oc2ccccc2)N(C(C)C)C(C)C)cc1
    InChI
    InChI=1S/C27H33N2O4P/c1-21(2)29(22(3)4)27(20-23-16-18-24(31-5)19-17-23)28-34(30,32-25-12-8-6-9-13-25)33-26-14-10-7-11-15-26/h6-19,21-22H,20H2,1-5H3/b28-27-
    MOLECULAR FORMULA
    C27H33N2O4P
    CROSS REFERENCES
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    canSAR653299

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.22
    AlogP 7.02
    HBond donors 0
    HBond acceptors 6
    Atoms 67
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR653299.