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canSAR1095382
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NAMES
    SMILES
    Cc1nn(-c2ccccc2)c(Cl)c1/C=C1\SC(=S)N(CC(=O)O)C1=O
    InChI
    InChI=1S/C16H12ClN3O3S2/c1-9-11(14(17)20(18-9)10-5-3-2-4-6-10)7-12-15(23)19(8-13(21)22)16(24)25-12/h2-7H,8H2,1H3,(H,21,22)/b12-7-
    MOLECULAR FORMULA
    C16H12ClN3O3S2
    CROSS REFERENCES
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    canSAR1095382

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.00
    AlogP 3.12
    HBond donors 1
    HBond acceptors 6
    Atoms 37
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1095382.