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canSAR913980
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NAMES
    SMILES
    COc1cc2c(cc1OC)[C@H](C[C@@H](O)c1ccc(Cl)cc1)NCC2
    InChI
    InChI=1S/C19H22ClNO3/c1-23-18-9-13-7-8-21-16(15(13)10-19(18)24-2)11-17(22)12-3-5-14(20)6-4-12/h3-6,9-10,16-17,21-22H,7-8,11H2,1-2H3/t16-,17+/m0/s1
    MOLECULAR FORMULA
    C19H22ClNO3
    CROSS REFERENCES
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    canSAR913980

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 347.13
    AlogP 3.67
    HBond donors 2
    HBond acceptors 4
    Atoms 46
    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 canSAR913980.