canSAR2179748
FEATURES
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NAMES
    SMILES
    Cc1cc(N=S(C)(C)=O)cc2ncnc(Nc3ccc(F)cc3O[C@@H](C)C(O)=NCC(C)O)c12
    InChI
    InChI=1S/C23H28FN5O4S/c1-13-8-17(29-34(4,5)32)10-19-21(13)22(27-12-26-19)28-18-7-6-16(24)9-20(18)33-15(3)23(31)25-11-14(2)30/h6-10,12,14-15,30H,11H2,1-5H3,(H,25,31)(H,26,27,28)/t14?,15-/m0/s1
    MOLECULAR FORMULA
    C23H28FN5O4S
    CROSS REFERENCES
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    canSAR2179748
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight489.18
    AlogP4.28
    HBond donors3
    HBond acceptors9
    Atoms62
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2179748.