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canSAR1091096
FEATURES
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NAMES
    SMILES
    COC(=O)[C@H](Cc1ccc2c(c1)COP(=O)(O)O2)NC(=O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](C)O
    InChI
    InChI=1S/C30H31N2O10P/c1-17(33)27(32-30(36)40-16-24-22-9-5-3-7-20(22)21-8-4-6-10-23(21)24)28(34)31-25(29(35)39-2)14-18-11-12-26-19(13-18)15-41-43(37,38)42-26/h3-13,17,24-25,27,33H,14-16H2,1-2H3,(H,31,34)(H,32,36)(H,37,38)/t17-,25+,27+/m1/s1
    MOLECULAR FORMULA
    C30H31N2O10P
    CROSS REFERENCES
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    canSAR1091096

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 610.17
    AlogP 3.18
    HBond donors 4
    HBond acceptors 12
    Atoms 74
    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 canSAR1091096.