canSAR1416971
FEATURES
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NAMES
    SMILES
    Cc1cc(N)nc(-c2ccn3c(-c4cccc(NC(=O)NCC(F)(F)F)c4)cnc3c2)n1
    InChI
    InChI=1S/C21H18F3N7O/c1-12-7-17(25)30-19(28-12)14-5-6-31-16(10-26-18(31)9-14)13-3-2-4-15(8-13)29-20(32)27-11-21(22,23)24/h2-10H,11H2,1H3,(H2,25,28,30)(H2,27,29,32)
    MOLECULAR FORMULA
    C21H18F3N7O
    CROSS REFERENCES
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    canSAR1416971
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight441.15
    AlogP4.03
    HBond donors4
    HBond acceptors8
    Atoms50
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1416971.