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canSAR648559
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NAMES
    SMILES
    CC(C)c1nc2c(C(F)(F)F)cccn2c1-c1cccc(Oc2cccc(CS(C)(=O)=O)c2)c1
    InChI
    InChI=1S/C25H23F3N2O3S/c1-16(2)22-23(30-12-6-11-21(24(30)29-22)25(26,27)28)18-8-5-10-20(14-18)33-19-9-4-7-17(13-19)15-34(3,31)32/h4-14,16H,15H2,1-3H3
    MOLECULAR FORMULA
    C25H23F3N2O3S
    CROSS REFERENCES
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    canSAR648559

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 488.14
    AlogP 6.48
    HBond donors 0
    HBond acceptors 5
    Atoms 57
    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 canSAR648559.