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canSAR1062527
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NAMES
    SMILES
    O=C(Oc1coc(CSc2ncccn2)cc1=O)c1cc([N+](=O)[O-])ccc1Cl
    InChI
    InChI=1S/C17H10ClN3O6S/c18-13-3-2-10(21(24)25)6-12(13)16(23)27-15-8-26-11(7-14(15)22)9-28-17-19-4-1-5-20-17/h1-8H,9H2
    MOLECULAR FORMULA
    C17H10ClN3O6S
    CROSS REFERENCES
    1062527 logo

    canSAR1062527

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.00
    AlogP 3.50
    HBond donors 0
    HBond acceptors 9
    Atoms 38
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1062527.