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canSAR196281
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NAMES
    SMILES
    O=C(CCCNCc1ccc2ccccc2c1)Nc1ccc2nc(NC(=O)C3CCCC3)sc2c1
    InChI
    InChI=1S/C28H30N4O2S/c33-26(10-5-15-29-18-19-11-12-20-6-1-4-9-22(20)16-19)30-23-13-14-24-25(17-23)35-28(31-24)32-27(34)21-7-2-3-8-21/h1,4,6,9,11-14,16-17,21,29H,2-3,5,7-8,10,15,18H2,(H,30,33)(H,31,32,34)
    MOLECULAR FORMULA
    C28H30N4O2S
    CROSS REFERENCES
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    canSAR196281

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 486.21
    AlogP 6.09
    HBond donors 3
    HBond acceptors 6
    Atoms 65
    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 canSAR196281.