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canSAR2016743
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NAMES
    SMILES
    COC(=O)[C@@]1(Cc2ccc(F)cc2)[C@H]2c3cc(C(=O)N(C)C)n(Cc4cc(F)cc5c4OCOC5)c3C[C@H]2CN1C(=O)c1ccccc1
    InChI
    InChI=1S/C37H35F2N3O6/c1-40(2)35(44)31-16-29-30(41(31)18-25-13-28(39)14-26-20-47-21-48-33(25)26)15-24-19-42(34(43)23-7-5-4-6-8-23)37(32(24)29,36(45)46-3)17-22-9-11-27(38)12-10-22/h4-14,16,24,32H,15,17-21H2,1-3H3/t24-,32+,37+/m0/s1
    MOLECULAR FORMULA
    C37H35F2N3O6
    CROSS REFERENCES
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    canSAR2016743

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 655.25
    AlogP 4.95
    HBond donors 0
    HBond acceptors 9
    Atoms 83
    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 canSAR2016743.