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canSAR650642
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NAMES
    SMILES
    N#CCc1c(C(=O)N2CCc3ccc(C(F)(F)F)cc3C2)nn(-c2ccccc2Cl)c1-c1ccc(Cl)cc1
    InChI
    InChI=1S/C28H19Cl2F3N4O/c29-21-9-6-18(7-10-21)26-22(11-13-34)25(35-37(26)24-4-2-1-3-23(24)30)27(38)36-14-12-17-5-8-20(28(31,32)33)15-19(17)16-36/h1-10,15H,11-12,14,16H2
    MOLECULAR FORMULA
    C28H19Cl2F3N4O
    CROSS REFERENCES
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    canSAR650642

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 554.09
    AlogP 7.13
    HBond donors 0
    HBond acceptors 5
    Atoms 57
    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 canSAR650642.