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canSAR1632709
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NAMES
    SMILES
    COC[C@@H](C)n1c(-c2cnc(OC)nc2OC)nc2c1C(c1ccc(C#N)cc1)N(c1cccc(Cl)c1F)C2=O
    InChI
    InChI=1S/C28H24ClFN6O4/c1-15(14-38-2)35-24-22(33-25(35)18-13-32-28(40-4)34-26(18)39-3)27(37)36(20-7-5-6-19(29)21(20)30)23(24)17-10-8-16(12-31)9-11-17/h5-11,13,15,23H,14H2,1-4H3/t15-,23?/m1/s1
    MOLECULAR FORMULA
    C28H24ClFN6O4
    CROSS REFERENCES
    1632709 logo

    canSAR1632709

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 562.15
    AlogP 4.98
    HBond donors 0
    HBond acceptors 10
    Atoms 64
    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 canSAR1632709.