canSAR1631939
FEATURES
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NAMES
    SMILES
    C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(C(=O)Nc3ccccc3N)cc2)Oc2c(NC(=O)Nc3ccc(F)cc3)cccc2C1=O
    InChI
    InChI=1S/C37H41FN6O5/c1-23-19-44(24(2)22-45)36(47)29-7-6-10-32(42-37(48)40-28-17-15-27(38)16-18-28)34(29)49-33(23)21-43(3)20-25-11-13-26(14-12-25)35(46)41-31-9-5-4-8-30(31)39/h4-18,23-24,33,45H,19-22,39H2,1-3H3,(H,41,46)(H2,40,42,48)/t23-,24+,33+/m1/s1
    MOLECULAR FORMULA
    C37H41FN6O5
    CROSS REFERENCES
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    canSAR1631939
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight668.31
    AlogP5.66
    HBond donors6
    HBond acceptors11
    Atoms90
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1631939.