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canSAR353092
FEATURES
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NAMES
    SMILES
    CC(=O)NC[C@H]1CN(c2ccn(-c3ccc(N4CCSCC4)c(F)c3)c2)C(=O)O1
    InChI
    InChI=1S/C20H23FN4O3S/c1-14(26)22-11-17-13-25(20(27)28-17)16-4-5-24(12-16)15-2-3-19(18(21)10-15)23-6-8-29-9-7-23/h2-5,10,12,17H,6-9,11,13H2,1H3,(H,22,26)/t17-/m0/s1
    MOLECULAR FORMULA
    C20H23FN4O3S
    CROSS REFERENCES
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    canSAR353092

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.15
    AlogP 2.63
    HBond donors 1
    HBond acceptors 7
    Atoms 52
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR353092.