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canSAR1024073
FEATURES
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NAMES
    SMILES
    O=C(N[C@@H](CSCc1ccc2ccccc2c1)C(=O)O)c1ncccc1O
    InChI
    InChI=1S/C20H18N2O4S/c23-17-6-3-9-21-18(17)19(24)22-16(20(25)26)12-27-11-13-7-8-14-4-1-2-5-15(14)10-13/h1-10,16,23H,11-12H2,(H,22,24)(H,25,26)/t16-/m0/s1
    MOLECULAR FORMULA
    C20H18N2O4S
    CROSS REFERENCES
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    canSAR1024073

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 382.10
    AlogP 3.06
    HBond donors 3
    HBond acceptors 6
    Atoms 45
    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 canSAR1024073.