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canSAR988554
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)C(=C[C@H](O)[C@@H]3[C@@H]2CC[C@@]2(C)[C@H]3CC[C@@H]2[C@H](C)CCCC(C)C)C1
    InChI
    InChI=1S/C39H68O3/c1-7-8-9-10-11-12-13-14-15-19-36(41)42-31-22-24-38(5)30(26-31)27-35(40)37-33-21-20-32(29(4)18-16-17-28(2)3)39(33,6)25-23-34(37)38/h27-29,31-35,37,40H,7-26H2,1-6H3/t29-,31+,32-,33+,34+,35+,37+,38+,39-/m1/s1
    MOLECULAR FORMULA
    C39H68O3
    CROSS REFERENCES
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    canSAR988554

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 584.52
    AlogP 10.83
    HBond donors 1
    HBond acceptors 3
    Atoms 110
    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 canSAR988554.