canSAR426252
FEATURES
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NAMES
    SMILES
    CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
    InChI
    InChI=1S/C42H59N11O5/c1-2-3-4-5-6-7-11-20-37(54)50-36(24-30-26-46-27-49-30)41(58)53-35(22-28-15-9-8-10-16-28)40(57)51-33(19-14-21-47-42(44)45)39(56)52-34(38(43)55)23-29-25-48-32-18-13-12-17-31(29)32/h8-10,12-13,15-18,25-27,33-36,48H,2-7,11,14,19-24H2,1H3,(H2,43,55)(H,46,49)(H,50,54)(H,51,57)(H,52,56)(H,53,58)(H4,44,45,47)/t33-,34-,35+,36-/m0/s1
    MOLECULAR FORMULA
    C42H59N11O5
    CROSS REFERENCES
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    canSAR426252
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight797.47
    AlogP2.54
    HBond donors12
    HBond acceptors16
    Atoms117
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR426252.