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canSAR1144864
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NAMES
    SMILES
    COCCN1CCN(c2cc3c(Nc4ccc(C)cc4F)c(C(N)=O)nnc3cc2OC)CC1
    InChI
    InChI=1S/C24H29FN6O3/c1-15-4-5-18(17(25)12-15)27-22-16-13-20(31-8-6-30(7-9-31)10-11-33-2)21(34-3)14-19(16)28-29-23(22)24(26)32/h4-5,12-14H,6-11H2,1-3H3,(H2,26,32)(H,27,28)
    MOLECULAR FORMULA
    C24H29FN6O3
    CROSS REFERENCES
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    canSAR1144864

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.23
    AlogP 2.70
    HBond donors 3
    HBond acceptors 9
    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 canSAR1144864.