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canSAR921402
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NAMES
    SMILES
    CCOc1cc2c3c(c4ccc(O)cc4c2cc1OCC)[C@H](O)[C@@H]1CCCN1C3
    InChI
    InChI=1S/C24H27NO4/c1-3-28-21-11-17-16-10-14(26)7-8-15(16)23-19(18(17)12-22(21)29-4-2)13-25-9-5-6-20(25)24(23)27/h7-8,10-12,20,24,26-27H,3-6,9,13H2,1-2H3/t20-,24+/m0/s1
    MOLECULAR FORMULA
    C24H27NO4
    CROSS REFERENCES
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    canSAR921402

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.19
    AlogP 4.51
    HBond donors 2
    HBond acceptors 5
    Atoms 56
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR921402.