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canSAR1588850
FEATURES
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NAMES
    SMILES
    Cn1c(CN2C(=O)CN(c3ccc(F)cc3)C2=O)nc2ccc(C(=O)N[C@H](C#N)CCCCN)cc21
    InChI
    InChI=1S/C25H26FN7O3/c1-31-21-12-16(24(35)29-18(13-28)4-2-3-11-27)5-10-20(21)30-22(31)14-33-23(34)15-32(25(33)36)19-8-6-17(26)7-9-19/h5-10,12,18H,2-4,11,14-15,27H2,1H3,(H,29,35)/t18-/m0/s1
    MOLECULAR FORMULA
    C25H26FN7O3
    CROSS REFERENCES
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    canSAR1588850

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 491.21
    AlogP 2.43
    HBond donors 3
    HBond acceptors 10
    Atoms 62
    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 canSAR1588850.