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canSAR648890
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NAMES
    SMILES
    O=C(CN1C(C(=O)c2ccccc2)=C(O)c2ccccc2S1(=O)=O)c1ccc(-c2ccccc2)cc1
    InChI
    InChI=1S/C29H21NO5S/c31-25(22-17-15-21(16-18-22)20-9-3-1-4-10-20)19-30-27(28(32)23-11-5-2-6-12-23)29(33)24-13-7-8-14-26(24)36(30,34)35/h1-18,33H,19H2
    MOLECULAR FORMULA
    C29H21NO5S
    CROSS REFERENCES
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    canSAR648890

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 495.11
    AlogP 5.35
    HBond donors 1
    HBond acceptors 6
    Atoms 57
    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 canSAR648890.