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canSAR1724292
FEATURES
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NAMES
    SMILES
    CC12CCC(C(=O)N3CCOCC3)([C@H](Br)C1=O)C2(C)C
    InChI
    InChI=1S/C15H22BrNO3/c1-13(2)14(3)4-5-15(13,10(16)11(14)18)12(19)17-6-8-20-9-7-17/h10H,4-9H2,1-3H3/t10-,14?,15?/m1/s1
    MOLECULAR FORMULA
    C15H22BrNO3
    CROSS REFERENCES
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    canSAR1724292

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 343.08
    AlogP 2.00
    HBond donors 0
    HBond acceptors 4
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1724292.