canSAR824065
FEATURES
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NAMES
    SMILES
    Nc1nc(O)c2c(n1)NCC(CCc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)s1)C2
    InChI
    InChI=1S/C19H23N5O6S/c20-19-23-15-11(16(27)24-19)7-9(8-21-15)1-2-10-3-5-13(31-10)17(28)22-12(18(29)30)4-6-14(25)26/h3,5,9,12H,1-2,4,6-8H2,(H,22,28)(H,25,26)(H,29,30)(H4,20,21,23,24,27)/t9?,12-/m0/s1
    MOLECULAR FORMULA
    C19H23N5O6S
    CROSS REFERENCES
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    canSAR824065
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight449.14
    AlogP1.09
    HBond donors7
    HBond acceptors11
    Atoms54
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824065.