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canSAR1831159
FEATURES
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NAMES
    SMILES
    Cn1cnnc1SCC(=O)NC1CCCN(Cc2ccccc2F)C1
    InChI
    InChI=1S/C17H22FN5OS/c1-22-12-19-21-17(22)25-11-16(24)20-14-6-4-8-23(10-14)9-13-5-2-3-7-15(13)18/h2-3,5,7,12,14H,4,6,8-11H2,1H3,(H,20,24)
    MOLECULAR FORMULA
    C17H22FN5OS
    CROSS REFERENCES
    1831159 logo

    canSAR1831159

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 363.15
    AlogP 1.83
    HBond donors 1
    HBond acceptors 6
    Atoms 47
    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 canSAR1831159.