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canSAR1127662
FEATURES
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NAMES
    SMILES
    NC(=O)C[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccc(S(N)(=O)=O)cc1)C(=O)O
    InChI
    InChI=1S/C17H22N6O9S/c18-12(24)5-11(17(29)30)23-15(27)8-21-13(25)6-20-14(26)7-22-16(28)9-1-3-10(4-2-9)33(19,31)32/h1-4,11H,5-8H2,(H2,18,24)(H,20,26)(H,21,25)(H,22,28)(H,23,27)(H,29,30)(H2,19,31,32)/t11-/m0/s1
    MOLECULAR FORMULA
    C17H22N6O9S
    CROSS REFERENCES
    1127662 logo

    canSAR1127662

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 486.12
    AlogP -4.26
    HBond donors 9
    HBond acceptors 15
    Atoms 55
    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 canSAR1127662.