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canSAR2205623
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NAMES
    SMILES
    Cn1c(=O)n(-c2ccc(C[C@H](NC(=O)c3cc(F)c(NS(=O)(=O)c4ccc(-n5cncn5)cc4)cc3F)C(=O)O)cn2)c(=O)c2ccncc21
    InChI
    InChI=1S/C31H23F2N9O7S/c1-40-26-14-34-9-8-20(26)29(44)42(31(40)47)27-7-2-17(13-36-27)10-25(30(45)46)38-28(43)21-11-23(33)24(12-22(21)32)39-50(48,49)19-5-3-18(4-6-19)41-16-35-15-37-41/h2-9,11-16,25,39H,10H2,1H3,(H,38,43)(H,45,46)/t25-/m0/s1
    MOLECULAR FORMULA
    C31H23F2N9O7S
    CROSS REFERENCES
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    canSAR2205623

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 703.14
    AlogP 1.56
    HBond donors 3
    HBond acceptors 16
    Atoms 73
    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 canSAR2205623.