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canSAR1125147
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NAMES
    SMILES
    O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccncc1)c1ccc(-c2cc(F)cc(F)c2)cc1F
    InChI
    InChI=1S/C29H21F3N4O2/c30-20-11-18(12-21(31)15-20)17-5-6-24(25(32)13-17)28(37)36-27(29(38)35-22-7-9-33-10-8-22)14-19-16-34-26-4-2-1-3-23(19)26/h1-13,15-16,27,34H,14H2,(H,36,37)(H,33,35,38)/t27-/m0/s1
    MOLECULAR FORMULA
    C29H21F3N4O2
    CROSS REFERENCES
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    canSAR1125147

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 514.16
    AlogP 5.63
    HBond donors 3
    HBond acceptors 6
    Atoms 59
    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 canSAR1125147.