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canSAR1146405
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NAMES
    SMILES
    Cc1[nH]c2c(c1C(=O)NCCCN1CCCC1)CCC/C2=C1/C(=O)Nc2ccc(F)cc21
    InChI
    InChI=1S/C25H29FN4O2/c1-15-21(24(31)27-10-5-13-30-11-2-3-12-30)17-6-4-7-18(23(17)28-15)22-19-14-16(26)8-9-20(19)29-25(22)32/h8-9,14,28H,2-7,10-13H2,1H3,(H,27,31)(H,29,32)/b22-18-
    MOLECULAR FORMULA
    C25H29FN4O2
    CROSS REFERENCES
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    canSAR1146405

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 436.23
    AlogP 3.88
    HBond donors 3
    HBond acceptors 6
    Atoms 61
    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 canSAR1146405.