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canSAR1985622
FEATURES
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NAMES
    SMILES
    COc1cccc(Oc2nc(NCc3cccc4ccccc34)c3ncn(Cc4ccc(-c5ccccc5)cc4)c3n2)c1
    InChI
    InChI=1S/C36H29N5O2/c1-42-30-14-8-15-31(21-30)43-36-39-34(37-22-29-13-7-12-28-11-5-6-16-32(28)29)33-35(40-36)41(24-38-33)23-25-17-19-27(20-18-25)26-9-3-2-4-10-26/h2-21,24H,22-23H2,1H3,(H,37,39,40)
    MOLECULAR FORMULA
    C36H29N5O2
    CROSS REFERENCES
    1985622 logo

    canSAR1985622

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 563.23
    AlogP 8.11
    HBond donors 1
    HBond acceptors 7
    Atoms 72
    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 canSAR1985622.