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canSAR1132912
FEATURES
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NAMES
    SMILES
    O=C(O)CCC(=O)N1N=C(c2c(-c3cc(F)cc(F)c3)c3ccccc3[nH]c2=O)CC1c1ccc(Cl)cc1
    InChI
    InChI=1S/C28H20ClF2N3O4/c29-17-7-5-15(6-8-17)23-14-22(33-34(23)24(35)9-10-25(36)37)27-26(16-11-18(30)13-19(31)12-16)20-3-1-2-4-21(20)32-28(27)38/h1-8,11-13,23H,9-10,14H2,(H,32,38)(H,36,37)
    MOLECULAR FORMULA
    C28H20ClF2N3O4
    CROSS REFERENCES
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    canSAR1132912

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 535.11
    AlogP 5.67
    HBond donors 2
    HBond acceptors 7
    Atoms 58
    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 canSAR1132912.