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canSAR2050117
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NAMES
    SMILES
    COC(=O)[C@H](CCSC)NC(=O)CNc1nc(NC(C)=O)nc2[nH]cnc12
    InChI
    InChI=1S/C15H21N7O4S/c1-8(23)19-15-21-12(11-13(22-15)18-7-17-11)16-6-10(24)20-9(4-5-27-3)14(25)26-2/h7,9H,4-6H2,1-3H3,(H,20,24)(H3,16,17,18,19,21,22,23)/t9-/m0/s1
    MOLECULAR FORMULA
    C15H21N7O4S
    CROSS REFERENCES
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    canSAR2050117

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 395.14
    AlogP 0.13
    HBond donors 4
    HBond acceptors 11
    Atoms 48
    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 canSAR2050117.