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canSAR1830144
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NAMES
    SMILES
    COc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)NCC[C@]314.Cl
    InChI
    InChI=1S/C17H19NO3.ClH/c1-20-13-5-2-9-8-11-10-3-4-12(19)16-17(10,6-7-18-11)14(9)15(13)21-16;/h2-5,10-12,16,18-19H,6-8H2,1H3;1H/t10-,11+,12-,16-,17-;/m0./s1
    MOLECULAR FORMULA
    C17H20ClNO3
    CROSS REFERENCES
    1830144 logo

    canSAR1830144

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 321.11
    AlogP 1.58
    HBond donors 2
    HBond acceptors 4
    Atoms 42
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1830144.