canSAR821679
FEATURES
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NAMES
    SMILES
    C#CCN(Cc1cc2c(O)nc(C)nc2cc1C)c1ccc(C(=O)N[C@@H](CCC(=O)N[C@@H](CCc2nnn[nH]2)C(=O)O)C(=O)O)c(F)c1
    InChI
    InChI=1S/C31H32FN9O7/c1-4-11-41(15-18-13-21-25(12-16(18)2)33-17(3)34-29(21)44)19-5-6-20(22(32)14-19)28(43)36-24(31(47)48)8-10-27(42)35-23(30(45)46)7-9-26-37-39-40-38-26/h1,5-6,12-14,23-24H,7-11,15H2,2-3H3,(H,35,42)(H,36,43)(H,45,46)(H,47,48)(H,33,34,44)(H,37,38,39,40)/t23-,24-/m0/s1
    MOLECULAR FORMULA
    C31H32FN9O7
    CROSS REFERENCES
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    canSAR821679
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight661.24
    AlogP1.41
    HBond donors6
    HBond acceptors16
    Atoms80
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR821679.