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canSAR1523639
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NAMES
    SMILES
    CCN(CC)C(=O)CSc1nnc(-c2ccccc2)n1-c1ccccc1
    InChI
    InChI=1S/C20H22N4OS/c1-3-23(4-2)18(25)15-26-20-22-21-19(16-11-7-5-8-12-16)24(20)17-13-9-6-10-14-17/h5-14H,3-4,15H2,1-2H3
    MOLECULAR FORMULA
    C20H22N4OS
    CROSS REFERENCES
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    canSAR1523639

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 366.15
    AlogP 3.89
    HBond donors 0
    HBond acceptors 5
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1523639.