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canSAR1403947
FEATURES
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NAMES
    SMILES
    CCOc1ccc(C(C)NC(=O)C(CC2=CC=C(OP(=O)(O)O)CC2)NC(C)=O)cc1C(N)=O
    InChI
    InChI=1S/C22H30N3O8P/c1-4-32-20-10-7-16(12-18(20)21(23)27)13(2)24-22(28)19(25-14(3)26)11-15-5-8-17(9-6-15)33-34(29,30)31/h5,7-8,10,12-13,19H,4,6,9,11H2,1-3H3,(H2,23,27)(H,24,28)(H,25,26)(H2,29,30,31)
    MOLECULAR FORMULA
    C22H30N3O8P
    CROSS REFERENCES
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    canSAR1403947

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 495.18
    AlogP 1.97
    HBond donors 6
    HBond acceptors 11
    Atoms 64
    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 canSAR1403947.