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canSAR1208413
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NAMES
    SMILES
    CNC1CN(C2c3ccccc3CSc3ccc(OC)cc32)C1
    InChI
    InChI=1S/C19H22N2OS/c1-20-14-10-21(11-14)19-16-6-4-3-5-13(16)12-23-18-8-7-15(22-2)9-17(18)19/h3-9,14,19-20H,10-12H2,1-2H3
    MOLECULAR FORMULA
    C19H22N2OS
    CROSS REFERENCES
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    canSAR1208413

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 326.15
    AlogP 3.29
    HBond donors 1
    HBond acceptors 3
    Atoms 45
    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 canSAR1208413.