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canSAR1118560
FEATURES
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NAMES
    SMILES
    CC(C)(C)c1ccccc1Oc1ncccc1Nc1nc(C(F)(F)F)c(-c2ccccc2O)s1
    InChI
    InChI=1S/C25H22F3N3O2S/c1-24(2,3)16-10-5-7-13-19(16)33-22-17(11-8-14-29-22)30-23-31-21(25(26,27)28)20(34-23)15-9-4-6-12-18(15)32/h4-14,32H,1-3H3,(H,30,31)
    MOLECULAR FORMULA
    C25H22F3N3O2S
    CROSS REFERENCES
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    canSAR1118560

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 485.14
    AlogP 7.76
    HBond donors 2
    HBond acceptors 5
    Atoms 56
    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 canSAR1118560.