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canSAR835972
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1cccc2c1CN(c1ncnc3c1nc1n3[C@@H]3O[C@H](CO1)[C@@H](O)[C@H]3O)CC2
    InChI
    InChI=1S/C19H18N6O6/c26-14-12-7-30-19-22-13-16(20-8-21-17(13)24(19)18(31-12)15(14)27)23-5-4-9-2-1-3-11(25(28)29)10(9)6-23/h1-3,8,12,14-15,18,26-27H,4-7H2/t12-,14-,15-,18-/m1/s1
    MOLECULAR FORMULA
    C19H18N6O6
    CROSS REFERENCES
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    canSAR835972

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 426.13
    AlogP 0.31
    HBond donors 2
    HBond acceptors 12
    Atoms 49
    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 canSAR835972.