canSAR1417435
FEATURES
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NAMES
    SMILES
    COC(=O)[C@@H](Cc1cc2ccnc(N)c2cc1OC(F)(F)F)N1CC[C@H](NS(=O)(=O)c2cnc(N3CCC(F)(F)C3)s2)C1=O
    InChI
    InChI=1S/C25H25F5N6O6S2/c1-41-22(38)17(9-14-8-13-2-5-32-20(31)15(13)10-18(14)42-25(28,29)30)36-6-3-16(21(36)37)34-44(39,40)19-11-33-23(43-19)35-7-4-24(26,27)12-35/h2,5,8,10-11,16-17,34H,3-4,6-7,9,12H2,1H3,(H2,31,32)/t16-,17+/m0/s1
    MOLECULAR FORMULA
    C25H25F5N6O6S2
    CROSS REFERENCES
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    canSAR1417435
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight664.12
    AlogP2.68
    HBond donors3
    HBond acceptors12
    Atoms69
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417435.