canSAR1087002
FEATURES
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NAMES
    SMILES
    N#Cc1c(N)c(C#N)c(-c2ccc(Cl)cc2)c2c1CC(c1ccc(Cl)cc1)S2
    InChI
    InChI=1S/C22H13Cl2N3S/c23-14-5-1-12(2-6-14)19-9-16-17(10-25)21(27)18(11-26)20(22(16)28-19)13-3-7-15(24)8-4-13/h1-8,19H,9,27H2
    MOLECULAR FORMULA
    C22H13Cl2N3S
    CROSS REFERENCES
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    canSAR1087002
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight421.02
    AlogP6.38
    HBond donors2
    HBond acceptors3
    Atoms41
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087002.