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canSAR563573
FEATURES
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NAMES
    SMILES
    CNC(=O)CCCNC(=O)[C@@H](C[C@H](O)[C@@H](N)C[C@H](Cc1ccc(OC)c(OCCCOC)c1)C(C)C)C(C)C
    InChI
    InChI=1S/C30H53N3O6/c1-20(2)23(16-22-11-12-27(38-7)28(17-22)39-15-9-14-37-6)18-25(31)26(34)19-24(21(3)4)30(36)33-13-8-10-29(35)32-5/h11-12,17,20-21,23-26,34H,8-10,13-16,18-19,31H2,1-7H3,(H,32,35)(H,33,36)/t23-,24-,25-,26-/m0/s1
    MOLECULAR FORMULA
    C30H53N3O6
    CROSS REFERENCES
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    canSAR563573

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 551.39
    AlogP 3.31
    HBond donors 5
    HBond acceptors 9
    Atoms 92
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR563573.