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canSAR1835404
FEATURES
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NAMES
    SMILES
    NC(=O)CC(NC(=O)Cc1cccc2ccccc12)c1ccc(N2CCCCCCC2)c([N+](=O)[O-])c1
    InChI
    InChI=1S/C28H32N4O4/c29-27(33)19-24(30-28(34)18-21-11-8-10-20-9-4-5-12-23(20)21)22-13-14-25(26(17-22)32(35)36)31-15-6-2-1-3-7-16-31/h4-5,8-14,17,24H,1-3,6-7,15-16,18-19H2,(H2,29,33)(H,30,34)
    MOLECULAR FORMULA
    C28H32N4O4
    CROSS REFERENCES
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    canSAR1835404

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 488.24
    AlogP 4.79
    HBond donors 3
    HBond acceptors 8
    Atoms 68
    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 canSAR1835404.