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canSAR1142200
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NAMES
    SMILES
    O=C(O)CCc1ccc(Nc2nc(-c3ccccc3)nc3c2CS(=O)(=O)C3)cc1
    InChI
    InChI=1S/C21H19N3O4S/c25-19(26)11-8-14-6-9-16(10-7-14)22-21-17-12-29(27,28)13-18(17)23-20(24-21)15-4-2-1-3-5-15/h1-7,9-10H,8,11-13H2,(H,25,26)(H,22,23,24)
    MOLECULAR FORMULA
    C21H19N3O4S
    CROSS REFERENCES
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    canSAR1142200

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 409.11
    AlogP 3.33
    HBond donors 2
    HBond acceptors 7
    Atoms 48
    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 canSAR1142200.