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canSAR1507289
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NAMES
    SMILES
    CCOP(=O)(OCC)c1nc(-c2cccc3ccccc23)oc1NCCc1ccc(OC)cc1
    InChI
    InChI=1S/C26H29N2O5P/c1-4-31-34(29,32-5-2)26-25(27-18-17-19-13-15-21(30-3)16-14-19)33-24(28-26)23-12-8-10-20-9-6-7-11-22(20)23/h6-16,27H,4-5,17-18H2,1-3H3
    MOLECULAR FORMULA
    C26H29N2O5P
    CROSS REFERENCES
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    canSAR1507289

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.18
    AlogP 6.05
    HBond donors 1
    HBond acceptors 7
    Atoms 63
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1507289.