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canSAR837350
FEATURES
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NAMES
    SMILES
    Nc1nc(N)c(CCCCc2csc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)c2)c(O)n1
    InChI
    InChI=1S/C18H23N5O6S/c19-14-10(15(26)23-18(20)22-14)4-2-1-3-9-7-12(30-8-9)16(27)21-11(17(28)29)5-6-13(24)25/h7-8,11H,1-6H2,(H,21,27)(H,24,25)(H,28,29)(H5,19,20,22,23,26)/t11-/m0/s1
    MOLECULAR FORMULA
    C18H23N5O6S
    CROSS REFERENCES
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    canSAR837350

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.14
    AlogP 1.02
    HBond donors 8
    HBond acceptors 11
    Atoms 53
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR837350.