canSAR1003970
FEATURES
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NAMES
    SMILES
    CCc1cn([C@H]2C[C@H](I)[C@@H](CO)O2)c(=O)[nH]c1=O
    InChI
    InChI=1S/C11H15IN2O4/c1-2-6-4-14(11(17)13-10(6)16)9-3-7(12)8(5-15)18-9/h4,7-9,15H,2-3,5H2,1H3,(H,13,16,17)/t7-,8+,9+/m0/s1
    MOLECULAR FORMULA
    C11H15IN2O4
    CROSS REFERENCES
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    canSAR1003970
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight366.01
    AlogP0.18
    HBond donors2
    HBond acceptors6
    Atoms33
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1003970.