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canSAR1512127
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NAMES
    SMILES
    CC(C)c1ccc(NC(=S)N2CCCC(c3ccc(F)cc3)=N2)cc1
    InChI
    InChI=1S/C20H22FN3S/c1-14(2)15-7-11-18(12-8-15)22-20(25)24-13-3-4-19(23-24)16-5-9-17(21)10-6-16/h5-12,14H,3-4,13H2,1-2H3,(H,22,25)
    MOLECULAR FORMULA
    C20H22FN3S
    CROSS REFERENCES
    1512127 logo

    canSAR1512127

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 355.15
    AlogP 5.15
    HBond donors 1
    HBond acceptors 3
    Atoms 47
    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 canSAR1512127.