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canSAR1100428
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NAMES
    SMILES
    COC(=O)c1ccc(-c2ccc(CSc3nc(C(C)C)nc4ccccc34)cc2)cc1
    InChI
    InChI=1S/C26H24N2O2S/c1-17(2)24-27-23-7-5-4-6-22(23)25(28-24)31-16-18-8-10-19(11-9-18)20-12-14-21(15-13-20)26(29)30-3/h4-15,17H,16H2,1-3H3
    MOLECULAR FORMULA
    C26H24N2O2S
    CROSS REFERENCES
    1100428 logo

    canSAR1100428

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.16
    AlogP 6.50
    HBond donors 0
    HBond acceptors 4
    Atoms 55
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1100428.