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canSAR1430466
FEATURES
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NAMES
    SMILES
    CCCCCCCOc1cccc(CCC(=O)OC[C@@H](O)COP(=O)(O)OC[C@H](N)C(=O)O)c1
    InChI
    InChI=1S/C22H36NO10P/c1-2-3-4-5-6-12-30-19-9-7-8-17(13-19)10-11-21(25)31-14-18(24)15-32-34(28,29)33-16-20(23)22(26)27/h7-9,13,18,20,24H,2-6,10-12,14-16,23H2,1H3,(H,26,27)(H,28,29)/t18-,20+/m1/s1
    MOLECULAR FORMULA
    C22H36NO10P
    CROSS REFERENCES
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    canSAR1430466

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 505.21
    AlogP 2.42
    HBond donors 5
    HBond acceptors 11
    Atoms 70
    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 canSAR1430466.