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canSAR653174
FEATURES
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NAMES
    SMILES
    NCCCC[C@@H]1NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(O)cc2)NC1=O
    InChI
    InChI=1S/C42H50N8O7/c43-19-7-6-13-32-38(53)49-35(22-27-15-17-29(51)18-16-27)42(57)50-20-8-14-36(50)41(56)45-25-37(52)46-33(21-26-9-2-1-3-10-26)39(54)48-34(40(55)47-32)23-28-24-44-31-12-5-4-11-30(28)31/h1-5,9-12,15-18,24,32-36,44,51H,6-8,13-14,19-23,25,43H2,(H,45,56)(H,46,52)(H,47,55)(H,48,54)(H,49,53)/t32-,33-,34-,35-,36-/m0/s1
    MOLECULAR FORMULA
    C42H50N8O7
    CROSS REFERENCES
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    canSAR653174

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 778.38
    AlogP 1.09
    HBond donors 9
    HBond acceptors 15
    Atoms 107
    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 canSAR653174.