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canSAR1589746
FEATURES
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NAMES
    SMILES
    CC(C)OC1[C@@H](OC(C)C)[C@@H](COP(=O)([O-])NCCC(=O)[O-])O[C@H]1n1c[nH+]c2c(=O)[nH]c(N)nc21
    InChI
    InChI=1S/C19H31N6O9P/c1-9(2)32-14-11(7-31-35(29,30)22-6-5-12(26)27)34-18(15(14)33-10(3)4)25-8-21-13-16(25)23-19(20)24-17(13)28/h8-11,14-15,18H,5-7H2,1-4H3,(H,26,27)(H2,22,29,30)(H3,20,23,24,28)/p-1/t11-,14+,15?,18-/m1/s1
    MOLECULAR FORMULA
    C19H30N6O9P-
    CROSS REFERENCES
    1589746 logo

    canSAR1589746

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 517.18
    AlogP -2.18
    HBond donors 5
    HBond acceptors 15
    Atoms 65
    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 canSAR1589746.