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canSAR1721483
FEATURES
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NAMES
    SMILES
    NC1=N[C@@H](CCc2ccc(Nc3ncc(F)cn3)cc2)CO1
    InChI
    InChI=1S/C15H16FN5O/c16-11-7-18-15(19-8-11)21-12-4-1-10(2-5-12)3-6-13-9-22-14(17)20-13/h1-2,4-5,7-8,13H,3,6,9H2,(H2,17,20)(H,18,19,21)/t13-/m0/s1
    MOLECULAR FORMULA
    C15H16FN5O
    CROSS REFERENCES
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    canSAR1721483

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 301.13
    AlogP 2.01
    HBond donors 3
    HBond acceptors 6
    Atoms 38
    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 canSAR1721483.