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canSAR185911
FEATURES
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NAMES
    SMILES
    CCC1=C(C(N)=O)C(c2ccc([N+](=O)[O-])cc2)N(C(=O)NCCCN2CCC(C(=O)OC)(c3ccccc3)CC2)C(=O)N1
    InChI
    InChI=1S/C30H36N6O7/c1-3-23-24(26(31)37)25(20-10-12-22(13-11-20)36(41)42)35(29(40)33-23)28(39)32-16-7-17-34-18-14-30(15-19-34,27(38)43-2)21-8-5-4-6-9-21/h4-6,8-13,25H,3,7,14-19H2,1-2H3,(H2,31,37)(H,32,39)(H,33,40)
    MOLECULAR FORMULA
    C30H36N6O7
    CROSS REFERENCES
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    canSAR185911

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 592.26
    AlogP 3.12
    HBond donors 4
    HBond acceptors 13
    Atoms 79
    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 canSAR185911.