canSAR1010968
FEATURES
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NAMES
    SMILES
    Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COP(=O)(CCl)N(C)C)O2)c(=O)[nH]c1=O
    InChI
    InChI=1S/C13H20ClN6O5P/c1-8-5-20(13(22)16-12(8)21)11-4-9(17-18-15)10(25-11)6-24-26(23,7-14)19(2)3/h5,9-11H,4,6-7H2,1-3H3,(H,16,21,22)/t9-,10+,11+,26?/m0/s1
    MOLECULAR FORMULA
    C13H20ClN6O5P
    CROSS REFERENCES
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    canSAR1010968
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight406.09
    AlogP1.78
    HBond donors1
    HBond acceptors11
    Atoms46
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1010968.