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canSAR1444782
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NAMES
    SMILES
    Cn1c(SCc2ccc(C#N)cc2Cl)nc2ccccc21
    InChI
    InChI=1S/C16H12ClN3S/c1-20-15-5-3-2-4-14(15)19-16(20)21-10-12-7-6-11(9-18)8-13(12)17/h2-8H,10H2,1H3
    MOLECULAR FORMULA
    C16H12ClN3S
    CROSS REFERENCES
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    canSAR1444782

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 313.04
    AlogP 4.39
    HBond donors 0
    HBond acceptors 3
    Atoms 33
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1444782.