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canSAR1616240
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NAMES
    SMILES
    COc1ccc2c(OCc3nnc4c(F)cc(-c5cc(C)ns5)cn34)ccnc2c1
    InChI
    InChI=1S/C21H16FN5O2S/c1-12-7-19(30-26-12)13-8-16(22)21-25-24-20(27(21)10-13)11-29-18-5-6-23-17-9-14(28-2)3-4-15(17)18/h3-10H,11H2,1-2H3
    MOLECULAR FORMULA
    C21H16FN5O2S
    CROSS REFERENCES
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    canSAR1616240

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 421.10
    AlogP 4.44
    HBond donors 0
    HBond acceptors 7
    Atoms 46
    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 canSAR1616240.