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canSAR727742
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NAMES
    SMILES
    O=C(O)/C=C/c1ccc(NC(=O)c2ccc3nc(-c4ccc(F)cc4)c(C4CCCCC4)nc3c2)cc1
    InChI
    InChI=1S/C30H26FN3O3/c31-23-12-9-21(10-13-23)29-28(20-4-2-1-3-5-20)34-26-18-22(11-16-25(26)33-29)30(37)32-24-14-6-19(7-15-24)8-17-27(35)36/h6-18,20H,1-5H2,(H,32,37)(H,35,36)/b17-8+
    MOLECULAR FORMULA
    C30H26FN3O3
    CROSS REFERENCES
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    canSAR727742

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 495.20
    AlogP 6.83
    HBond donors 2
    HBond acceptors 6
    Atoms 63
    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 canSAR727742.