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canSAR1013335
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NAMES
    SMILES
    O=C(N1CCN(Cc2ccccc2)CC1)N1CC(OC(c2ccc(Cl)cc2)c2cccnc2Cl)C1
    InChI
    InChI=1S/C27H28Cl2N4O2/c28-22-10-8-21(9-11-22)25(24-7-4-12-30-26(24)29)35-23-18-33(19-23)27(34)32-15-13-31(14-16-32)17-20-5-2-1-3-6-20/h1-12,23,25H,13-19H2
    MOLECULAR FORMULA
    C27H28Cl2N4O2
    CROSS REFERENCES
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    canSAR1013335

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 510.16
    AlogP 5.12
    HBond donors 0
    HBond acceptors 6
    Atoms 63
    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 canSAR1013335.