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canSAR1443840
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NAMES
    SMILES
    COC(=O)[C@@]1(Cc2ccc(F)cc2)[C@H]2c3cc(C(=O)N4CCCC4)n(C)c3C[C@H]2CN1C(=O)c1ccccc1
    InChI
    InChI=1S/C31H32FN3O4/c1-33-25-16-22-19-35(28(36)21-8-4-3-5-9-21)31(30(38)39-2,18-20-10-12-23(32)13-11-20)27(22)24(25)17-26(33)29(37)34-14-6-7-15-34/h3-5,8-13,17,22,27H,6-7,14-16,18-19H2,1-2H3/t22-,27+,31+/m0/s1
    MOLECULAR FORMULA
    C31H32FN3O4
    CROSS REFERENCES
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    canSAR1443840

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 529.24
    AlogP 3.97
    HBond donors 0
    HBond acceptors 7
    Atoms 71
    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 canSAR1443840.