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canSAR82884
FEATURES
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NAMES
    SMILES
    CC(C)(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCC(=O)O)C(=O)O
    InChI
    InChI=1S/C18H30N4O10/c1-18(2,3)13(17(31)32)22-15(29)9(6-12(26)27)20-16(30)10(7-23)21-14(28)8(19)4-5-11(24)25/h8-10,13,23H,4-7,19H2,1-3H3,(H,20,30)(H,21,28)(H,22,29)(H,24,25)(H,26,27)(H,31,32)/t8-,9-,10-,13+/m0/s1
    MOLECULAR FORMULA
    C18H30N4O10
    CROSS REFERENCES
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    canSAR82884

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.20
    AlogP -2.77
    HBond donors 9
    HBond acceptors 14
    Atoms 62
    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 canSAR82884.