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canSAR1067358
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NAMES
    SMILES
    c1ccc(CN2CCC[C@@H](n3cnc4cnc5[nH]ccc5c43)C2)cc1
    InChI
    InChI=1S/C20H21N5/c1-2-5-15(6-3-1)12-24-10-4-7-16(13-24)25-14-23-18-11-22-20-17(19(18)25)8-9-21-20/h1-3,5-6,8-9,11,14,16H,4,7,10,12-13H2,(H,21,22)/t16-/m1/s1
    MOLECULAR FORMULA
    C20H21N5
    CROSS REFERENCES
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    canSAR1067358

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.18
    AlogP 3.75
    HBond donors 1
    HBond acceptors 5
    Atoms 46
    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 canSAR1067358.