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canSAR1089916
FEATURES
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NAMES
    SMILES
    N[C@](CCCCB(O)O)(CCN1CC[C@@H](CO)C1)C(=O)O
    InChI
    InChI=1S/C13H27BN2O5/c15-13(12(18)19,4-1-2-6-14(20)21)5-8-16-7-3-11(9-16)10-17/h11,17,20-21H,1-10,15H2,(H,18,19)/t11-,13-/m1/s1
    MOLECULAR FORMULA
    C13H27BN2O5
    CROSS REFERENCES
    1089916 logo

    canSAR1089916

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 302.20
    AlogP -0.88
    HBond donors 6
    HBond acceptors 7
    Atoms 48
    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 canSAR1089916.