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canSAR1514410
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NAMES
    SMILES
    COC(=O)c1c[nH]c(-c2cc(Oc3ccc(NC(=O)Nc4ccc(F)c(C(F)(F)F)c4)cc3)ccn2)c1
    InChI
    InChI=1S/C25H18F4N4O4/c1-36-23(34)14-10-21(31-13-14)22-12-18(8-9-30-22)37-17-5-2-15(3-6-17)32-24(35)33-16-4-7-20(26)19(11-16)25(27,28)29/h2-13,31H,1H3,(H2,32,33,35)
    MOLECULAR FORMULA
    C25H18F4N4O4
    CROSS REFERENCES
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    canSAR1514410

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 514.13
    AlogP 6.46
    HBond donors 3
    HBond acceptors 8
    Atoms 55
    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 canSAR1514410.