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canSAR1650913
FEATURES
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NAMES
    SMILES
    CC(C)(C)c1ccccc1OCC(=O)NCCCn1ccnc1
    InChI
    InChI=1S/C18H25N3O2/c1-18(2,3)15-7-4-5-8-16(15)23-13-17(22)20-9-6-11-21-12-10-19-14-21/h4-5,7-8,10,12,14H,6,9,11,13H2,1-3H3,(H,20,22)
    MOLECULAR FORMULA
    C18H25N3O2
    CROSS REFERENCES
    1650913 logo

    canSAR1650913

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 315.19
    AlogP 2.77
    HBond donors 1
    HBond acceptors 5
    Atoms 48
    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 canSAR1650913.