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canSAR1093957
FEATURES
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NAMES
    SMILES
    NC(=O)CNC(=O)[C@H](Cc1ccc2c(c1)COP(=O)(O)O2)NC(=O)OCC1c2ccccc2-c2ccccc21
    InChI
    InChI=1S/C27H26N3O8P/c28-25(31)13-29-26(32)23(12-16-9-10-24-17(11-16)14-37-39(34,35)38-24)30-27(33)36-15-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-11,22-23H,12-15H2,(H2,28,31)(H,29,32)(H,30,33)(H,34,35)/t23-/m0/s1
    MOLECULAR FORMULA
    C27H26N3O8P
    CROSS REFERENCES
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    canSAR1093957

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 551.15
    AlogP 2.75
    HBond donors 5
    HBond acceptors 11
    Atoms 65
    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 canSAR1093957.