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canSAR504282
FEATURES
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NAMES
    SMILES
    CCCC1(CCc2ccccc2)CC(=O)C(C(CC)c2cccc(NS(=O)(=O)c3cccc4cccnc34)c2)=C(O)O1
    InChI
    InChI=1S/C34H36N2O5S/c1-3-19-34(20-18-24-11-6-5-7-12-24)23-29(37)31(33(38)41-34)28(4-2)26-14-8-16-27(22-26)36-42(39,40)30-17-9-13-25-15-10-21-35-32(25)30/h5-17,21-22,28,36,38H,3-4,18-20,23H2,1-2H3
    MOLECULAR FORMULA
    C34H36N2O5S
    CROSS REFERENCES
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    canSAR504282

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 584.23
    AlogP 7.46
    HBond donors 2
    HBond acceptors 7
    Atoms 78
    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 canSAR504282.