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canSAR1616879
FEATURES
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NAMES
    SMILES
    OC[C@@H]1CN(Cc2ccc3c(c2)OCO3)C[C@H](n2cnc3c(NCc4ccncc4)ncnc32)O1
    InChI
    InChI=1S/C24H25N7O4/c32-12-18-10-30(9-17-1-2-19-20(7-17)34-15-33-19)11-21(35-18)31-14-29-22-23(27-13-28-24(22)31)26-8-16-3-5-25-6-4-16/h1-7,13-14,18,21,32H,8-12,15H2,(H,26,27,28)/t18-,21+/m0/s1
    MOLECULAR FORMULA
    C24H25N7O4
    CROSS REFERENCES
    1616879 logo

    canSAR1616879

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.20
    AlogP 1.95
    HBond donors 2
    HBond acceptors 11
    Atoms 60
    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 canSAR1616879.