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canSAR2096224
FEATURES
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NAMES
    SMILES
    O=C(/C=C/c1ccccc1)N[C@H](COC(=O)c1ccncc1)C(=O)NC1CCCCC1
    InChI
    InChI=1S/C24H27N3O4/c28-22(12-11-18-7-3-1-4-8-18)27-21(23(29)26-20-9-5-2-6-10-20)17-31-24(30)19-13-15-25-16-14-19/h1,3-4,7-8,11-16,20-21H,2,5-6,9-10,17H2,(H,26,29)(H,27,28)/b12-11+/t21-/m1/s1
    MOLECULAR FORMULA
    C24H27N3O4
    CROSS REFERENCES
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    canSAR2096224

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 421.20
    AlogP 2.89
    HBond donors 2
    HBond acceptors 7
    Atoms 58
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096224.