canSAR1604134
FEATURES
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NAMES
    SMILES
    CC(C)C[C@@H](C(=O)O)n1cc(-c2cc(C(=O)N3CCNCC3)cc(-c3cn([C@@H](CCC(=O)O)C(=O)O)nn3)c2)nn1
    InChI
    InChI=1S/C26H32N8O7/c1-15(2)9-22(26(40)41)34-14-20(29-31-34)17-10-16(11-18(12-17)24(37)32-7-5-27-6-8-32)19-13-33(30-28-19)21(25(38)39)3-4-23(35)36/h10-15,21-22,27H,3-9H2,1-2H3,(H,35,36)(H,38,39)(H,40,41)/t21-,22-/m0/s1
    MOLECULAR FORMULA
    C26H32N8O7
    CROSS REFERENCES
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    canSAR1604134
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight568.24
    AlogP1.41
    HBond donors4
    HBond acceptors15
    Atoms73
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1604134.