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canSAR2002555
FEATURES
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NAMES
    SMILES
    C[C@H](NC(=O)c1ccc2c(ccn2Cc2ccc(-c3ccccc3C(=O)OC(C)(C)C)cc2)c1)c1ccc([N+](=O)[O-])cc1
    InChI
    InChI=1S/C35H33N3O5/c1-23(25-13-16-29(17-14-25)38(41)42)36-33(39)28-15-18-32-27(21-28)19-20-37(32)22-24-9-11-26(12-10-24)30-7-5-6-8-31(30)34(40)43-35(2,3)4/h5-21,23H,22H2,1-4H3,(H,36,39)/t23-/m0/s1
    MOLECULAR FORMULA
    C35H33N3O5
    CROSS REFERENCES
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    canSAR2002555

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 575.24
    AlogP 7.71
    HBond donors 1
    HBond acceptors 8
    Atoms 76
    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 canSAR2002555.