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canSAR1633342
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NAMES
    SMILES
    Cc1ccc(F)c(NC(=O)Nc2ccc(Oc3ccnc(-c4cc(C(=O)NCCCC(=O)NO)c[nH]4)c3)cc2)c1
    InChI
    InChI=1S/C28H27FN6O5/c1-17-4-9-22(29)23(13-17)34-28(38)33-19-5-7-20(8-6-19)40-21-10-12-30-25(15-21)24-14-18(16-32-24)27(37)31-11-2-3-26(36)35-39/h4-10,12-16,32,39H,2-3,11H2,1H3,(H,31,37)(H,35,36)(H2,33,34,38)
    MOLECULAR FORMULA
    C28H27FN6O5
    CROSS REFERENCES
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    canSAR1633342

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 546.20
    AlogP 4.98
    HBond donors 6
    HBond acceptors 11
    Atoms 67
    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 canSAR1633342.