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canSAR1828265
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NAMES
    SMILES
    C=C(C)[C@@H]1CC[C@]2(COC(=O)c3ccccc3C(F)(F)F)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12
    InChI
    InChI=1S/C38H53F3O3/c1-23(2)24-14-19-37(22-44-32(43)25-10-8-9-11-26(25)38(39,40)41)21-20-35(6)27(31(24)37)12-13-29-34(5)17-16-30(42)33(3,4)28(34)15-18-36(29,35)7/h8-11,24,27-31,42H,1,12-22H2,2-7H3/t24-,27+,28-,29+,30-,31+,34-,35+,36+,37+/m0/s1
    MOLECULAR FORMULA
    C38H53F3O3
    CROSS REFERENCES
    1828265 logo

    canSAR1828265

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 614.39
    AlogP 9.88
    HBond donors 1
    HBond acceptors 3
    Atoms 97
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1828265.