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canSAR913633
FEATURES
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NAMES
    SMILES
    C#C[C@]1(O)CC[C@H]2[C@H]3[C@H](CC[C@@]21C)c1ccc(O)c(F)c1C[C@H]3C
    InChI
    InChI=1S/C21H25FO2/c1-4-21(24)10-8-16-18-12(2)11-15-13(5-6-17(23)19(15)22)14(18)7-9-20(16,21)3/h1,5-6,12,14,16,18,23-24H,7-11H2,2-3H3/t12-,14-,16+,18-,20+,21+/m1/s1
    MOLECULAR FORMULA
    C21H25FO2
    CROSS REFERENCES
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    canSAR913633

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 328.18
    AlogP 4.00
    HBond donors 2
    HBond acceptors 2
    Atoms 49
    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 canSAR913633.