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canSAR928046
FEATURES
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NAMES
    SMILES
    CCOC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2ccc3c(-c4ccccc4)ncnc32)[C@H](O)[C@@H]1O)Oc1ccccc1
    InChI
    InChI=1S/C28H31N4O8P/c1-3-37-28(35)18(2)31-41(36,40-20-12-8-5-9-13-20)38-16-22-24(33)25(34)27(39-22)32-15-14-21-23(29-17-30-26(21)32)19-10-6-4-7-11-19/h4-15,17-18,22,24-25,27,33-34H,3,16H2,1-2H3,(H,31,36)/t18-,22+,24+,25+,27+,41?/m0/s1
    MOLECULAR FORMULA
    C28H31N4O8P
    CROSS REFERENCES
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    canSAR928046

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 582.19
    AlogP 3.46
    HBond donors 3
    HBond acceptors 12
    Atoms 72
    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 canSAR928046.