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canSAR1621016
FEATURES
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NAMES
    SMILES
    CCOc1ccc(CCNC(=O)c2cccnc2N2CCCC2)cc1OCC
    InChI
    InChI=1S/C22H29N3O3/c1-3-27-19-10-9-17(16-20(19)28-4-2)11-13-24-22(26)18-8-7-12-23-21(18)25-14-5-6-15-25/h7-10,12,16H,3-6,11,13-15H2,1-2H3,(H,24,26)
    MOLECULAR FORMULA
    C22H29N3O3
    CROSS REFERENCES
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    canSAR1621016

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.22
    AlogP 3.45
    HBond donors 1
    HBond acceptors 6
    Atoms 57
    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 canSAR1621016.