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canSAR1648974
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NAMES
    SMILES
    CC(=O)Nc1nc(SCC(=O)NCc2ccc(F)cc2)nc(O)c1NC(=O)c1cccs1
    InChI
    InChI=1S/C20H18FN5O4S2/c1-11(27)23-17-16(24-18(29)14-3-2-8-31-14)19(30)26-20(25-17)32-10-15(28)22-9-12-4-6-13(21)7-5-12/h2-8H,9-10H2,1H3,(H,22,28)(H,24,29)(H2,23,25,26,27,30)
    MOLECULAR FORMULA
    C20H18FN5O4S2
    CROSS REFERENCES
    1648974 logo

    canSAR1648974

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.08
    AlogP 3.00
    HBond donors 4
    HBond acceptors 9
    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 canSAR1648974.