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canSAR1766724
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NAMES
    SMILES
    CN1CCC[C@@H](COc2ccnc3ccc(C#CCNC(=O)c4cccn(Cc5cc(F)c(F)c(F)c5)c4=O)cc23)C1
    InChI
    InChI=1S/C32H29F3N4O3/c1-38-13-3-6-22(18-38)20-42-29-10-12-36-28-9-8-21(15-25(28)29)5-2-11-37-31(40)24-7-4-14-39(32(24)41)19-23-16-26(33)30(35)27(34)17-23/h4,7-10,12,14-17,22H,3,6,11,13,18-20H2,1H3,(H,37,40)/t22-/m1/s1
    MOLECULAR FORMULA
    C32H29F3N4O3
    CROSS REFERENCES
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    canSAR1766724

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 574.22
    AlogP 4.36
    HBond donors 1
    HBond acceptors 7
    Atoms 71
    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 canSAR1766724.