canSAR1932223
FEATURES
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NAMES
    SMILES
    CC[C@]12c3[nH]c4cc(-c5ccco5)ccc4c3CCN1C(=O)[C@@H](CC(=O)NCc1ccco1)C[C@@H]2C(=O)N1CCN(C(=O)C2CC2)CC1
    InChI
    InChI=1S/C37H41N5O6/c1-2-37-29(36(46)41-15-13-40(14-16-41)34(44)23-7-8-23)19-25(21-32(43)38-22-26-5-3-17-47-26)35(45)42(37)12-11-28-27-10-9-24(31-6-4-18-48-31)20-30(27)39-33(28)37/h3-6,9-10,17-18,20,23,25,29,39H,2,7-8,11-16,19,21-22H2,1H3,(H,38,43)/t25-,29-,37+/m1/s1
    MOLECULAR FORMULA
    C37H41N5O6
    CROSS REFERENCES
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    canSAR1932223
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight651.31
    AlogP4.43
    HBond donors2
    HBond acceptors11
    Atoms89
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1932223.