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canSAR1091977
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NAMES
    SMILES
    CC(C)C[C@H](CO)Nc1nc(S[C@@H](C)c2ccccc2F)nc2nc(N)sc12
    InChI
    InChI=1S/C19H24FN5OS2/c1-10(2)8-12(9-26)22-16-15-17(23-18(21)28-15)25-19(24-16)27-11(3)13-6-4-5-7-14(13)20/h4-7,10-12,26H,8-9H2,1-3H3,(H3,21,22,23,24,25)/t11-,12+/m0/s1
    MOLECULAR FORMULA
    C19H24FN5OS2
    CROSS REFERENCES
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    canSAR1091977

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 421.14
    AlogP 4.48
    HBond donors 4
    HBond acceptors 6
    Atoms 52
    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 canSAR1091977.