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canSAR783347
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NAMES
    SMILES
    Cc1ccc(C)c(NC(=O)CSc2nnc(-c3ccoc3C)n2Cc2ccco2)c1
    InChI
    InChI=1S/C22H22N4O3S/c1-14-6-7-15(2)19(11-14)23-20(27)13-30-22-25-24-21(18-8-10-28-16(18)3)26(22)12-17-5-4-9-29-17/h4-11H,12-13H2,1-3H3,(H,23,27)
    MOLECULAR FORMULA
    C22H22N4O3S
    CROSS REFERENCES
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    canSAR783347

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 422.14
    AlogP 4.84
    HBond donors 1
    HBond acceptors 7
    Atoms 52
    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 canSAR783347.