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canSAR91830
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NAMES
    SMILES
    CNc1nccc(-c2ccc(C(=O)N[C@H](CO)Cc3ccc(Cl)cc3Cl)s2)n1
    InChI
    InChI=1S/C19H18Cl2N4O2S/c1-22-19-23-7-6-15(25-19)16-4-5-17(28-16)18(27)24-13(10-26)8-11-2-3-12(20)9-14(11)21/h2-7,9,13,26H,8,10H2,1H3,(H,24,27)(H,22,23,25)/t13-/m0/s1
    MOLECULAR FORMULA
    C19H18Cl2N4O2S
    CROSS REFERENCES
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    canSAR91830

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 436.05
    AlogP 3.89
    HBond donors 3
    HBond acceptors 6
    Atoms 46
    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 canSAR91830.