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canSAR1431312
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NAMES
    SMILES
    COc1ccc(C2c3ccccc3Oc3ncn(CCN4CCOCC4)c(=N)c32)cc1OC
    InChI
    InChI=1S/C25H28N4O4/c1-30-20-8-7-17(15-21(20)31-2)22-18-5-3-4-6-19(18)33-25-23(22)24(26)29(16-27-25)10-9-28-11-13-32-14-12-28/h3-8,15-16,22,26H,9-14H2,1-2H3
    MOLECULAR FORMULA
    C25H28N4O4
    CROSS REFERENCES
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    canSAR1431312

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.21
    AlogP 3.00
    HBond donors 1
    HBond acceptors 8
    Atoms 61
    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 canSAR1431312.