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canSAR1266041
FEATURES
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NAMES
    SMILES
    CC=C1[C@H](O)CC(=C/C=C2\CCC[C@@]3(C)[C@H]2CC[C@@H]3[C@H](C)CCCC(C)(C)O)C[C@H]1O
    InChI
    InChI=1S/C28H46O3/c1-6-22-25(29)17-20(18-26(22)30)11-12-21-10-8-16-28(5)23(13-14-24(21)28)19(2)9-7-15-27(3,4)31/h6,11-12,19,23-26,29-31H,7-10,13-18H2,1-5H3/b20-11-,21-12+,22-6-/t19-,23-,24+,25-,26-,28-/m1/s1
    MOLECULAR FORMULA
    C28H46O3
    CROSS REFERENCES
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    canSAR1266041

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 430.34
    AlogP 6.09
    HBond donors 3
    HBond acceptors 3
    Atoms 77
    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 canSAR1266041.