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canSAR650215
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NAMES
    SMILES
    c1cc2c(c(OC3CCN(c4ccc(-n5ccnc5)nn4)CC3)c1)CCC2
    InChI
    InChI=1S/C21H23N5O/c1-3-16-4-2-6-19(18(16)5-1)27-17-9-12-25(13-10-17)20-7-8-21(24-23-20)26-14-11-22-15-26/h2,4,6-8,11,14-15,17H,1,3,5,9-10,12-13H2
    MOLECULAR FORMULA
    C21H23N5O
    CROSS REFERENCES
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    canSAR650215

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.19
    AlogP 3.20
    HBond donors 0
    HBond acceptors 6
    Atoms 50
    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 canSAR650215.