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canSAR1587968
FEATURES
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NAMES
    SMILES
    COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@@]31CCN(C(=O)CCN1CCCC1)C2
    InChI
    InChI=1S/C23H30N2O4/c1-28-18-5-4-16-15-25(20(27)7-12-24-10-2-3-11-24)13-9-23-8-6-17(26)14-19(23)29-22(18)21(16)23/h4-6,8,17,19,26H,2-3,7,9-15H2,1H3/t17-,19-,23-/m0/s1
    MOLECULAR FORMULA
    C23H30N2O4
    CROSS REFERENCES
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    canSAR1587968

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.22
    AlogP 2.23
    HBond donors 1
    HBond acceptors 6
    Atoms 59
    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 canSAR1587968.