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canSAR1062316
FEATURES
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NAMES
    SMILES
    CCNC(=O)c1cc(Oc2cccc(NC(=S)Nc3ccc(F)c(F)c3)c2)ccn1
    InChI
    InChI=1S/C21H18F2N4O2S/c1-2-24-20(28)19-12-16(8-9-25-19)29-15-5-3-4-13(10-15)26-21(30)27-14-6-7-17(22)18(23)11-14/h3-12H,2H2,1H3,(H,24,28)(H2,26,27,30)
    MOLECULAR FORMULA
    C21H18F2N4O2S
    CROSS REFERENCES
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    canSAR1062316

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.11
    AlogP 4.71
    HBond donors 3
    HBond acceptors 6
    Atoms 48
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1062316.