canSAR1791608
FEATURES
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NAMES
    SMILES
    Nc1nc2c(ncn2[C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OP([O-])([O-])=S)[C@@H](O)[C@H]2O)c(=O)[nH]1.[Li+].[Li+].[Li+].[Li+]
    InChI
    InChI=1S/C10H16N5O13P3S.4Li/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(26-9)1-25-29(19,20)27-30(21,22)28-31(23,24)32;;;;/h2-3,5-6,9,16-17H,1H2,(H,19,20)(H,21,22)(H2,23,24,32)(H3,11,13,14,18);;;;/q;4*+1/p-4/t3-,5-,6-,9-;;;;/m1..../s1
    MOLECULAR FORMULA
    C10H12Li4N5O13P3S
    CROSS REFERENCES
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    canSAR1791608
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight563.00
    AlogP-16.73
    HBond donors5
    HBond acceptors18
    Atoms48
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1791608.