canSAR590695
FEATURES
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NAMES
    SMILES
    CC(C)N(c1c(F)c(Oc2cccc(C(=N)N)c2)nc(Oc2ccc(C(=O)NCc3cccs3)cc2C(=O)O)c1F)C(C)C
    InChI
    InChI=1S/C31H31F2N5O5S/c1-16(2)38(17(3)4)26-24(32)29(42-20-8-5-7-18(13-20)27(34)35)37-30(25(26)33)43-23-11-10-19(14-22(23)31(40)41)28(39)36-15-21-9-6-12-44-21/h5-14,16-17H,15H2,1-4H3,(H3,34,35)(H,36,39)(H,40,41)
    MOLECULAR FORMULA
    C31H31F2N5O5S
    CROSS REFERENCES
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    canSAR590695
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight623.20
    AlogP6.54
    HBond donors5
    HBond acceptors10
    Atoms75
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR590695.