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canSAR2021690
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NAMES
    SMILES
    COC(=O)c1ccc(C23CC4(C2)[C@@H](c2ccccc2)N(Cc2ccc(C(F)(F)F)cc2)C[C@@H]4C3c2ccc(C(F)(F)F)cc2)cc1
    InChI
    InChI=1S/C37H31F6NO2/c1-46-33(45)26-11-15-27(16-12-26)34-21-35(22-34)30(31(34)24-9-17-29(18-10-24)37(41,42)43)20-44(32(35)25-5-3-2-4-6-25)19-23-7-13-28(14-8-23)36(38,39)40/h2-18,30-32H,19-22H2,1H3/t30-,31?,32-,34?,35?/m1/s1
    MOLECULAR FORMULA
    C37H31F6NO2
    CROSS REFERENCES
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    canSAR2021690

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 635.23
    AlogP 9.20
    HBond donors 0
    HBond acceptors 3
    Atoms 77
    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 canSAR2021690.