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canSAR988628
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)[C@@H](N)CC(N)=O)B(O)O
    InChI
    InChI=1S/C9H20BN3O4/c1-5(2)3-7(10(16)17)13-9(15)6(11)4-8(12)14/h5-7,16-17H,3-4,11H2,1-2H3,(H2,12,14)(H,13,15)/t6-,7-/m0/s1
    MOLECULAR FORMULA
    C9H20BN3O4
    CROSS REFERENCES
    988628 logo

    canSAR988628

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 245.15
    AlogP -2.27
    HBond donors 7
    HBond acceptors 7
    Atoms 37
    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 canSAR988628.