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canSAR78330
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NAMES
    SMILES
    CCCCc1nn(CC(F)(F)F)c(C(=O)O)c1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1
    InChI
    InChI=1S/C24H23F3N6O2/c1-2-3-8-20-19(21(23(34)35)33(30-20)14-24(25,26)27)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-28-31-32-29-22/h4-7,9-12H,2-3,8,13-14H2,1H3,(H,34,35)(H,28,29,31,32)
    MOLECULAR FORMULA
    C24H23F3N6O2
    CROSS REFERENCES
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    canSAR78330

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 484.18
    AlogP 4.92
    HBond donors 2
    HBond acceptors 8
    Atoms 58
    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 canSAR78330.