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canSAR791698
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NAMES
    SMILES
    O=C1CC[C@@H]2[C@H]3c4c(ccc(O)c4O[C@@H]13)C[C@H]2NCC1CC1
    InChI
    InChI=1S/C18H21NO3/c20-13-5-3-10-7-12(19-8-9-1-2-9)11-4-6-14(21)18-16(11)15(10)17(13)22-18/h3,5,9,11-12,16,18-20H,1-2,4,6-8H2/t11-,12+,16-,18-/m0/s1
    MOLECULAR FORMULA
    C18H21NO3
    CROSS REFERENCES
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    canSAR791698

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 299.15
    AlogP 2.14
    HBond donors 2
    HBond acceptors 4
    Atoms 43
    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 canSAR791698.