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canSAR1587496
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NAMES
    SMILES
    COc1ccc(/C=C/C(=O)Nc2ccc(-n3nncc3-c3ccc(OC)c(OC)c3)cc2)cc1OC
    InChI
    InChI=1S/C27H26N4O5/c1-33-23-12-5-18(15-25(23)35-3)6-14-27(32)29-20-8-10-21(11-9-20)31-22(17-28-30-31)19-7-13-24(34-2)26(16-19)36-4/h5-17H,1-4H3,(H,29,32)/b14-6+
    MOLECULAR FORMULA
    C27H26N4O5
    CROSS REFERENCES
    1587496 logo

    canSAR1587496

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 486.19
    AlogP 4.62
    HBond donors 1
    HBond acceptors 9
    Atoms 62
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1587496.