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canSAR1727119
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NAMES
    SMILES
    O=C(NC1CCCC1)C(c1ccccn1)N(C(=O)c1csnn1)c1ccc(F)cc1
    InChI
    InChI=1S/C21H20FN5O2S/c22-14-8-10-16(11-9-14)27(21(29)18-13-30-26-25-18)19(17-7-3-4-12-23-17)20(28)24-15-5-1-2-6-15/h3-4,7-13,15,19H,1-2,5-6H2,(H,24,28)
    MOLECULAR FORMULA
    C21H20FN5O2S
    CROSS REFERENCES
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    canSAR1727119

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.13
    AlogP 3.52
    HBond donors 1
    HBond acceptors 7
    Atoms 50
    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 canSAR1727119.