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canSAR1060496
FEATURES
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NAMES
    SMILES
    CO[C@@H](C(=O)NCC1CCCN(C(=O)C2CC2)C1)[C@H](O)[C@@H](O)[C@H](O)/C=C/C(C)(C)C
    InChI
    InChI=1S/C22H38N2O6/c1-22(2,3)10-9-16(25)17(26)18(27)19(30-4)20(28)23-12-14-6-5-11-24(13-14)21(29)15-7-8-15/h9-10,14-19,25-27H,5-8,11-13H2,1-4H3,(H,23,28)/b10-9+/t14?,16-,17+,18-,19-/m1/s1
    MOLECULAR FORMULA
    C22H38N2O6
    CROSS REFERENCES
    1060496 logo

    canSAR1060496

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 426.27
    AlogP 0.45
    HBond donors 4
    HBond acceptors 8
    Atoms 68
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1060496.