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canSAR1621151
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NAMES
    SMILES
    O=C(c1cc(-n2cnnc2)ccc1Cl)N1CCN(c2nc(-c3ccccc3)cs2)CC1
    InChI
    InChI=1S/C22H19ClN6OS/c23-19-7-6-17(29-14-24-25-15-29)12-18(19)21(30)27-8-10-28(11-9-27)22-26-20(13-31-22)16-4-2-1-3-5-16/h1-7,12-15H,8-11H2
    MOLECULAR FORMULA
    C22H19ClN6OS
    CROSS REFERENCES
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    canSAR1621151

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.10
    AlogP 4.01
    HBond donors 0
    HBond acceptors 7
    Atoms 50
    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 canSAR1621151.