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canSAR1617362
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NAMES
    SMILES
    COc1ccc(C2c3c(N)nc(CCCc4ccccc4)nc3Oc3ccc4ccccc4c32)cc1OC
    InChI
    InChI=1S/C32H29N3O3/c1-36-24-17-16-22(19-26(24)37-2)28-29-23-13-7-6-12-21(23)15-18-25(29)38-32-30(28)31(33)34-27(35-32)14-8-11-20-9-4-3-5-10-20/h3-7,9-10,12-13,15-19,28H,8,11,14H2,1-2H3,(H2,33,34,35)
    MOLECULAR FORMULA
    C32H29N3O3
    CROSS REFERENCES
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    canSAR1617362

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 503.22
    AlogP 6.69
    HBond donors 2
    HBond acceptors 6
    Atoms 67
    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 canSAR1617362.