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canSAR560677
FEATURES
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NAMES
    SMILES
    N=C(N)N1CCC[C@H](NC(=O)CN2C(=O)[C@H](NS(=O)(=O)Cc3ccccc3)CCc3ccccc32)C1O.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C25H32N6O5S.C2HF3O2/c26-25(27)30-14-6-10-19(23(30)33)28-22(32)15-31-21-11-5-4-9-18(21)12-13-20(24(31)34)29-37(35,36)16-17-7-2-1-3-8-17;3-2(4,5)1(6)7/h1-5,7-9,11,19-20,23,29,33H,6,10,12-16H2,(H3,26,27)(H,28,32);(H,6,7)/t19-,20+,23?;/m0./s1
    MOLECULAR FORMULA
    C27H33F3N6O7S
    CROSS REFERENCES
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    canSAR560677

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 642.21
    AlogP 0.88
    HBond donors 7
    HBond acceptors 13
    Atoms 77
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR560677.