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canSAR503994
FEATURES
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NAMES
    SMILES
    CC(=O)NC(Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)NC(Cc1ccccc1F)C(=O)O)C(C)O
    InChI
    InChI=1S/C41H54FN7O14/c1-20(2)15-27(47-40(61)34(22(4)50)49-39(60)28(44-23(5)51)16-24-11-7-6-8-12-24)37(58)46-29(18-32(52)53)36(57)43-21(3)35(56)45-30(19-33(54)55)38(59)48-31(41(62)63)17-25-13-9-10-14-26(25)42/h6-14,20-22,27-31,34,50H,15-19H2,1-5H3,(H,43,57)(H,44,51)(H,45,56)(H,46,58)(H,47,61)(H,48,59)(H,49,60)(H,52,53)(H,54,55)(H,62,63)/t21-,22?,27-,28?,29-,30-,31?,34-/m0/s1
    MOLECULAR FORMULA
    C41H54FN7O14
    CROSS REFERENCES
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    canSAR503994

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 887.37
    AlogP -1.49
    HBond donors 11
    HBond acceptors 21
    Atoms 117
    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 canSAR503994.