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canSAR501542
FEATURES
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NAMES
    SMILES
    CC(=O)CCC(=O)N1CCC[C@@H]1C(=O)NCCCCCCCCCCC[C@@H]1Cc2cc(O)ccc2C2CC[C@@]3(C)C(CC[C@@H]3O)C21
    InChI
    InChI=1S/C39H60N2O5/c1-27(42)15-20-36(45)41-24-12-14-34(41)38(46)40-23-11-9-7-5-3-4-6-8-10-13-28-25-29-26-30(43)16-17-31(29)32-21-22-39(2)33(37(28)32)18-19-35(39)44/h16-17,26,28,32-35,37,43-44H,3-15,18-25H2,1-2H3,(H,40,46)/t28-,32?,33?,34-,35+,37?,39+/m1/s1
    MOLECULAR FORMULA
    C39H60N2O5
    CROSS REFERENCES
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    canSAR501542

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 636.45
    AlogP 7.21
    HBond donors 3
    HBond acceptors 7
    Atoms 106
    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 canSAR501542.