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canSAR1156058
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NAMES
    SMILES
    O=C1c2ccccc2C(=O)c2c1ccc1nc(SC(=O)N3CCOCC3)[nH]c21
    InChI
    InChI=1S/C20H15N3O4S/c24-17-11-3-1-2-4-12(11)18(25)15-13(17)5-6-14-16(15)22-19(21-14)28-20(26)23-7-9-27-10-8-23/h1-6H,7-10H2,(H,21,22)
    MOLECULAR FORMULA
    C20H15N3O4S
    CROSS REFERENCES
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    canSAR1156058

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.08
    AlogP 2.88
    HBond donors 1
    HBond acceptors 7
    Atoms 43
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1156058.