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canSAR1826781
FEATURES
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NAMES
    SMILES
    CC(C)CNCC(=O)NC(C1CCCCC1)P(=O)(Oc1ccccc1)Oc1ccccc1
    InChI
    InChI=1S/C25H35N2O4P/c1-20(2)18-26-19-24(28)27-25(21-12-6-3-7-13-21)32(29,30-22-14-8-4-9-15-22)31-23-16-10-5-11-17-23/h4-5,8-11,14-17,20-21,25-26H,3,6-7,12-13,18-19H2,1-2H3,(H,27,28)
    MOLECULAR FORMULA
    C25H35N2O4P
    CROSS REFERENCES
    1826781 logo

    canSAR1826781

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.23
    AlogP 5.61
    HBond donors 2
    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 canSAR1826781.