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canSAR1409290
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NAMES
    SMILES
    CC(C)N1CCC(c2ccc(C[C@@H](C#N)NC(=O)[C@H]3N[C@@H]4CC[C@H]3C4)c(F)c2)CC1
    InChI
    InChI=1S/C24H33FN4O/c1-15(2)29-9-7-16(8-10-29)17-3-4-18(22(25)13-17)11-21(14-26)28-24(30)23-19-5-6-20(12-19)27-23/h3-4,13,15-16,19-21,23,27H,5-12H2,1-2H3,(H,28,30)/t19-,20+,21-,23-/m0/s1
    MOLECULAR FORMULA
    C24H33FN4O
    CROSS REFERENCES
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    canSAR1409290

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.26
    AlogP 3.10
    HBond donors 2
    HBond acceptors 5
    Atoms 63
    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 canSAR1409290.