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canSAR227913
FEATURES
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NAMES
    SMILES
    O=C(CCOCCc1ccccc1)NCCNCCc1ccc(O)c2nc(O)sc12
    InChI
    InChI=1S/C22H27N3O4S/c26-18-7-6-17(21-20(18)25-22(28)30-21)8-11-23-12-13-24-19(27)10-15-29-14-9-16-4-2-1-3-5-16/h1-7,23,26H,8-15H2,(H,24,27)(H,25,28)
    MOLECULAR FORMULA
    C22H27N3O4S
    CROSS REFERENCES
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    canSAR227913

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 429.17
    AlogP 2.61
    HBond donors 4
    HBond acceptors 7
    Atoms 57
    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 canSAR227913.