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canSAR1269459
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NAMES
    SMILES
    O=C(CCCCc1ccccc1)n1sc2ccccc2c1=O
    InChI
    InChI=1S/C18H17NO2S/c20-17(13-7-4-10-14-8-2-1-3-9-14)19-18(21)15-11-5-6-12-16(15)22-19/h1-3,5-6,8-9,11-12H,4,7,10,13H2
    MOLECULAR FORMULA
    C18H17NO2S
    CROSS REFERENCES
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    canSAR1269459

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 311.10
    AlogP 4.12
    HBond donors 0
    HBond acceptors 3
    Atoms 39
    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 canSAR1269459.