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canSAR2000459
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NAMES
    SMILES
    CN1C2C=C(N(CCc3ccccc3)C(=O)c3ccc(Cl)cc3)CC1CC2.Cl
    InChI
    InChI=1S/C23H25ClN2O.ClH/c1-25-20-11-12-21(25)16-22(15-20)26(14-13-17-5-3-2-4-6-17)23(27)18-7-9-19(24)10-8-18;/h2-10,15,20-21H,11-14,16H2,1H3;1H
    MOLECULAR FORMULA
    C23H26Cl2N2O
    CROSS REFERENCES
    2000459 logo

    canSAR2000459

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 416.14
    AlogP 5.20
    HBond donors 0
    HBond acceptors 3
    Atoms 54
    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 canSAR2000459.