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canSAR1409370
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NAMES
    SMILES
    Cl.c1ccc(C2(c3ccccc3)OC[C@@H](C3CCCCN3)O2)cc1
    InChI
    InChI=1S/C20H23NO2.ClH/c1-3-9-16(10-4-1)20(17-11-5-2-6-12-17)22-15-19(23-20)18-13-7-8-14-21-18;/h1-6,9-12,18-19,21H,7-8,13-15H2;1H/t18?,19-;/m0./s1
    MOLECULAR FORMULA
    C20H24ClNO2
    CROSS REFERENCES
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    canSAR1409370

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 345.15
    AlogP 3.87
    HBond donors 1
    HBond acceptors 3
    Atoms 48
    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 canSAR1409370.