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canSAR1092589
FEATURES
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NAMES
    SMILES
    C=C(CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C)C(C)C
    InChI
    InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h17-18,20,23-26H,3,7-16H2,1-2,4-6H3/t20-,23+,24-,25+,26+,27+,28-/m1/s1
    MOLECULAR FORMULA
    C28H44O
    CROSS REFERENCES
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    canSAR1092589

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 396.34
    AlogP 7.76
    HBond donors 0
    HBond acceptors 1
    Atoms 73
    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 canSAR1092589.