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canSAR1512514
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NAMES
    SMILES
    CNC(=O)c1ccc(N2C(=S)N(c3ccc(C#N)c(C(F)(F)F)c3)C(=O)C23CCN(C)CC3)cc1F
    InChI
    InChI=1S/C24H21F4N5O2S/c1-30-20(34)17-6-5-16(12-19(17)25)33-22(36)32(21(35)23(33)7-9-31(2)10-8-23)15-4-3-14(13-29)18(11-15)24(26,27)28/h3-6,11-12H,7-10H2,1-2H3,(H,30,34)
    MOLECULAR FORMULA
    C24H21F4N5O2S
    CROSS REFERENCES
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    canSAR1512514

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 519.14
    AlogP 3.68
    HBond donors 1
    HBond acceptors 7
    Atoms 57
    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 canSAR1512514.