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canSAR1493022
FEATURES
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NAMES
    SMILES
    CCc1cc(C)c(C(=O)N2CCC(F)(c3ccc(C#N)cc3)CC2)cc1NC(=O)c1ccc(N2CCOCC2)nc1
    InChI
    InChI=1S/C32H34FN5O3/c1-3-24-18-22(2)27(31(40)38-12-10-32(33,11-13-38)26-7-4-23(20-34)5-8-26)19-28(24)36-30(39)25-6-9-29(35-21-25)37-14-16-41-17-15-37/h4-9,18-19,21H,3,10-17H2,1-2H3,(H,36,39)
    MOLECULAR FORMULA
    C32H34FN5O3
    CROSS REFERENCES
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    canSAR1493022

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 555.26
    AlogP 5.01
    HBond donors 1
    HBond acceptors 8
    Atoms 75
    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 canSAR1493022.