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canSAR1717407
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NAMES
    SMILES
    COc1cccc(OCCCCN2CC(C)OC(C)C2)c1.O=C(O)C(=O)O
    InChI
    InChI=1S/C17H27NO3.C2H2O4/c1-14-12-18(13-15(2)21-14)9-4-5-10-20-17-8-6-7-16(11-17)19-3;3-1(4)2(5)6/h6-8,11,14-15H,4-5,9-10,12-13H2,1-3H3;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C19H29NO7
    CROSS REFERENCES
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    canSAR1717407

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.19
    AlogP 2.12
    HBond donors 2
    HBond acceptors 8
    Atoms 56
    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 canSAR1717407.