canSAR2169093
FEATURES
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NAMES
    SMILES
    NCCO.O=C(NCCCc1c(C(=O)O)[nH]c(=O)[nH]c1=O)c1ccc2ccccc2c1
    InChI
    InChI=1S/C19H17N3O5.C2H7NO/c23-16(13-8-7-11-4-1-2-5-12(11)10-13)20-9-3-6-14-15(18(25)26)21-19(27)22-17(14)24;3-1-2-4/h1-2,4-5,7-8,10H,3,6,9H2,(H,20,23)(H,25,26)(H2,21,22,24,27);4H,1-3H2
    MOLECULAR FORMULA
    C21H24N4O6
    CROSS REFERENCES
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    canSAR2169093
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight428.17
    AlogP0.21
    HBond donors7
    HBond acceptors10
    Atoms55
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2169093.