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canSAR2017980
FEATURES
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NAMES
    SMILES
    CCc1cccc(Nc2c([N+](=O)[O-])nn(-c3ccc4c(c3)OCCO4)[n+]2[O-])c1
    InChI
    InChI=1S/C18H17N5O5/c1-2-12-4-3-5-13(10-12)19-17-18(23(25)26)20-21(22(17)24)14-6-7-15-16(11-14)28-9-8-27-15/h3-7,10-11,19H,2,8-9H2,1H3
    MOLECULAR FORMULA
    C18H17N5O5
    CROSS REFERENCES
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    canSAR2017980

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.12
    AlogP 2.49
    HBond donors 1
    HBond acceptors 10
    Atoms 45
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2017980.