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canSAR1769099
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NAMES
    SMILES
    Cc1cc2c(cn1)c(C(N)=O)nn2CC(=O)N1[C@H](C(=O)Nc2cccc(OC(F)(F)F)c2F)C[C@H]2C[C@H]21
    InChI
    InChI=1S/C23H20F4N6O4/c1-10-5-15-12(8-29-10)20(21(28)35)31-32(15)9-18(34)33-14-6-11(14)7-16(33)22(36)30-13-3-2-4-17(19(13)24)37-23(25,26)27/h2-5,8,11,14,16H,6-7,9H2,1H3,(H2,28,35)(H,30,36)/t11-,14-,16+/m1/s1
    MOLECULAR FORMULA
    C23H20F4N6O4
    CROSS REFERENCES
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    canSAR1769099

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 520.15
    AlogP 2.50
    HBond donors 3
    HBond acceptors 10
    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 canSAR1769099.