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canSAR1124429
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(NC(=N)N)cc1)NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O
    InChI
    InChI=1S/C34H51FN12O6/c1-18(2)14-25(30(51)44-24(28(37)49)4-3-13-42-33(38)39)46-32(53)27(16-20-7-11-22(12-8-20)43-34(40)41)47-31(52)26(45-29(50)23(36)17-48)15-19-5-9-21(35)10-6-19/h5-12,18,23-27,48H,3-4,13-17,36H2,1-2H3,(H2,37,49)(H,44,51)(H,45,50)(H,46,53)(H,47,52)(H4,38,39,42)(H4,40,41,43)/t23-,24-,25-,26-,27-/m0/s1
    MOLECULAR FORMULA
    C34H51FN12O6
    CROSS REFERENCES
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    canSAR1124429

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 742.40
    AlogP -2.24
    HBond donors 17
    HBond acceptors 18
    Atoms 104
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1124429.