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canSAR1596386
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NAMES
    SMILES
    CCc1cc(=O)oc2cc(OCC(=O)N3CC[C@@]4(O)CCCC[C@H]4C3)ccc12
    InChI
    InChI=1S/C22H27NO5/c1-2-15-11-21(25)28-19-12-17(6-7-18(15)19)27-14-20(24)23-10-9-22(26)8-4-3-5-16(22)13-23/h6-7,11-12,16,26H,2-5,8-10,13-14H2,1H3/t16-,22-/m0/s1
    MOLECULAR FORMULA
    C22H27NO5
    CROSS REFERENCES
    1596386 logo

    canSAR1596386

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.19
    AlogP 2.89
    HBond donors 1
    HBond acceptors 6
    Atoms 55
    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 canSAR1596386.