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canSAR1831619
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NAMES
    SMILES
    Cc1n[nH]c(S/C(=C/c2ccc(-c3ccc(Cl)cc3)o2)C(=O)O)n1
    InChI
    InChI=1S/C16H12ClN3O3S/c1-9-18-16(20-19-9)24-14(15(21)22)8-12-6-7-13(23-12)10-2-4-11(17)5-3-10/h2-8H,1H3,(H,21,22)(H,18,19,20)/b14-8+
    MOLECULAR FORMULA
    C16H12ClN3O3S
    CROSS REFERENCES
    1831619 logo

    canSAR1831619

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.03
    AlogP 4.24
    HBond donors 2
    HBond acceptors 6
    Atoms 36
    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 canSAR1831619.