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canSAR1149638
FEATURES
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NAMES
    SMILES
    CCC[C@H]1C2CC[C@@H]3[C@H](CC[C@@]4(C)[C@H]3CC[C@@H]4[C@H](C)CCCC(C)C)[C@@]2(C)CC[C@H]1O
    InChI
    InChI=1S/C30H54O/c1-7-9-23-26-13-12-22-25-15-14-24(21(4)11-8-10-20(2)3)29(25,5)18-16-27(22)30(26,6)19-17-28(23)31/h20-28,31H,7-19H2,1-6H3/t21-,22+,23+,24-,25+,26?,27+,28-,29-,30+/m1/s1
    MOLECULAR FORMULA
    C30H54O
    CROSS REFERENCES
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    canSAR1149638

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 430.42
    AlogP 8.49
    HBond donors 1
    HBond acceptors 1
    Atoms 85
    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 canSAR1149638.