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canSAR126756
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NAMES
    SMILES
    Nc1ncnc2c1c(-c1cccc(O)c1)cn2-c1ccc(OCCNCCO)cc1
    InChI
    InChI=1S/C22H23N5O3/c23-21-20-19(15-2-1-3-17(29)12-15)13-27(22(20)26-14-25-21)16-4-6-18(7-5-16)30-11-9-24-8-10-28/h1-7,12-14,24,28-29H,8-11H2,(H2,23,25,26)
    MOLECULAR FORMULA
    C22H23N5O3
    CROSS REFERENCES
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    canSAR126756

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 405.18
    AlogP 2.34
    HBond donors 5
    HBond acceptors 8
    Atoms 53
    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 canSAR126756.