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canSAR1429149
FEATURES
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NAMES
    SMILES
    NCCC[C@@H]1N=C(c2ccc3ccccc3c2)c2[nH]c(C(=O)O)cc2N(CCc2ccc(O)cc2)C1=O
    InChI
    InChI=1S/C29H28N4O4/c30-14-3-6-23-28(35)33(15-13-18-7-11-22(34)12-8-18)25-17-24(29(36)37)32-27(25)26(31-23)21-10-9-19-4-1-2-5-20(19)16-21/h1-2,4-5,7-12,16-17,23,32,34H,3,6,13-15,30H2,(H,36,37)/t23-/m0/s1
    MOLECULAR FORMULA
    C29H28N4O4
    CROSS REFERENCES
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    canSAR1429149

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 496.21
    AlogP 4.11
    HBond donors 5
    HBond acceptors 8
    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 canSAR1429149.