canSAR1087559
FEATURES
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NAMES
    SMILES
    CCN1CCN(C(=O)N[C@@H](C(=O)N[C@@H](Cc2cccc(C(=O)O)c2)B(O)O)c2ccc(O)cc2)C(=O)C1=O
    InChI
    InChI=1S/C24H27BN4O9/c1-2-28-10-11-29(22(33)21(28)32)24(36)27-19(15-6-8-17(30)9-7-15)20(31)26-18(25(37)38)13-14-4-3-5-16(12-14)23(34)35/h3-9,12,18-19,30,37-38H,2,10-11,13H2,1H3,(H,26,31)(H,27,36)(H,34,35)/t18-,19+/m0/s1
    MOLECULAR FORMULA
    C24H27BN4O9
    CROSS REFERENCES
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    canSAR1087559
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight526.19
    AlogP-0.73
    HBond donors6
    HBond acceptors13
    Atoms65
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087559.