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canSAR1430940
FEATURES
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NAMES
    SMILES
    CC(=O)OC[C@H]1O[C@H](C#Cc2ccc(C(C)(C)C)cc2)C=C[C@@H]1OC(C)=O
    InChI
    InChI=1S/C22H26O5/c1-15(23)25-14-21-20(26-16(2)24)13-12-19(27-21)11-8-17-6-9-18(10-7-17)22(3,4)5/h6-7,9-10,12-13,19-21H,14H2,1-5H3/t19-,20+,21-/m1/s1
    MOLECULAR FORMULA
    C22H26O5
    CROSS REFERENCES
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    canSAR1430940

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 370.18
    AlogP 3.15
    HBond donors 0
    HBond acceptors 5
    Atoms 53
    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 canSAR1430940.