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canSAR2276333
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NAMES
    SMILES
    COc1ccc(C2(C)CCCc3nc(SCc4c(F)cc(C(=O)NCCOCCOCCOCCO)cc4F)n(-c4ccc(F)cc4)c32)cc1OC
    InChI
    InChI=1S/C38H44F3N3O7S/c1-38(26-6-11-33(47-2)34(23-26)48-3)12-4-5-32-35(38)44(28-9-7-27(39)8-10-28)37(43-32)52-24-29-30(40)21-25(22-31(29)41)36(46)42-13-15-49-17-19-51-20-18-50-16-14-45/h6-11,21-23,45H,4-5,12-20,24H2,1-3H3,(H,42,46)
    MOLECULAR FORMULA
    C38H44F3N3O7S
    CROSS REFERENCES
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    canSAR2276333

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 743.29
    AlogP 6.01
    HBond donors 2
    HBond acceptors 10
    Atoms 96
    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 canSAR2276333.