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canSAR1633480
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NAMES
    SMILES
    O=C(Nc1cc(-c2ccc3nc(NC4CC4)sc3c2)cnc1Cl)c1cccc(Cl)c1
    InChI
    InChI=1S/C22H16Cl2N4OS/c23-15-3-1-2-13(8-15)21(29)27-18-9-14(11-25-20(18)24)12-4-7-17-19(10-12)30-22(28-17)26-16-5-6-16/h1-4,7-11,16H,5-6H2,(H,26,28)(H,27,29)
    MOLECULAR FORMULA
    C22H16Cl2N4OS
    CROSS REFERENCES
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    canSAR1633480

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 454.04
    AlogP 6.49
    HBond donors 2
    HBond acceptors 5
    Atoms 46
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1633480.