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canSAR1090067
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NAMES
    SMILES
    O=C(CC12CC3CC(CC(C3)C1)C2)NCCCC(=O)N1CCN(Cc2ccccc2)CC1
    InChI
    InChI=1S/C27H39N3O2/c31-25(19-27-16-22-13-23(17-27)15-24(14-22)18-27)28-8-4-7-26(32)30-11-9-29(10-12-30)20-21-5-2-1-3-6-21/h1-3,5-6,22-24H,4,7-20H2,(H,28,31)
    MOLECULAR FORMULA
    C27H39N3O2
    CROSS REFERENCES
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    canSAR1090067

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.30
    AlogP 3.83
    HBond donors 1
    HBond acceptors 5
    Atoms 71
    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 canSAR1090067.