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canSAR1523234
FEATURES
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NAMES
    SMILES
    CC1(C)OC[C@H]([C@H]2O[P@@](=O)(c3ccccc3)[C@H](Nc3ccc4ccccc4c3)[C@H]3OC(C)(C)O[C@H]32)O1
    InChI
    InChI=1S/C28H32NO6P/c1-27(2)31-17-22(32-27)23-24-25(34-28(3,4)33-24)26(36(30,35-23)21-12-6-5-7-13-21)29-20-15-14-18-10-8-9-11-19(18)16-20/h5-16,22-26,29H,17H2,1-4H3/t22-,23-,24+,25+,26+,36+/m1/s1
    MOLECULAR FORMULA
    C28H32NO6P
    CROSS REFERENCES
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    canSAR1523234

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 509.20
    AlogP 5.25
    HBond donors 1
    HBond acceptors 7
    Atoms 68
    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 canSAR1523234.