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canSAR347519
FEATURES
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NAMES
    SMILES
    O=C1C2=C(C(=O)c3ccccc31)[C@]1(CS2)NC(=O)[C@H](Cc2ccccc2)NC1=O
    InChI
    InChI=1S/C22H16N2O4S/c25-17-13-8-4-5-9-14(13)18(26)19-16(17)22(11-29-19)21(28)23-15(20(27)24-22)10-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,23,28)(H,24,27)/t15-,22-/m0/s1
    MOLECULAR FORMULA
    C22H16N2O4S
    CROSS REFERENCES
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    canSAR347519

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.08
    AlogP 1.66
    HBond donors 2
    HBond acceptors 6
    Atoms 45
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR347519.