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canSAR1863224
FEATURES
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NAMES
    SMILES
    COCC(=O)N(C)c1nnc(-c2ccc([N+](=O)[O-])cc2)s1
    InChI
    InChI=1S/C12H12N4O4S/c1-15(10(17)7-20-2)12-14-13-11(21-12)8-3-5-9(6-4-8)16(18)19/h3-6H,7H2,1-2H3
    MOLECULAR FORMULA
    C12H12N4O4S
    CROSS REFERENCES
    1863224 logo

    canSAR1863224

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 308.06
    AlogP 1.72
    HBond donors 0
    HBond acceptors 8
    Atoms 33
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1863224.