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canSAR1124548
FEATURES
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NAMES
    SMILES
    COc1cc2c(Oc3ccc(NC(=O)c4cc(-c5ccccc5)ccn4)cc3F)ccnc2cc1OCCCN1CCOCC1
    InChI
    InChI=1S/C35H33FN4O5/c1-42-33-22-27-29(23-34(33)44-17-5-14-40-15-18-43-19-16-40)37-13-11-31(27)45-32-9-8-26(21-28(32)36)39-35(41)30-20-25(10-12-38-30)24-6-3-2-4-7-24/h2-4,6-13,20-23H,5,14-19H2,1H3,(H,39,41)
    MOLECULAR FORMULA
    C35H33FN4O5
    CROSS REFERENCES
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    canSAR1124548

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 608.24
    AlogP 6.59
    HBond donors 1
    HBond acceptors 9
    Atoms 78
    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 canSAR1124548.