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canSAR1725104
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NAMES
    SMILES
    COc1ccc2[nH]cc(CCNC(=O)C3CC(=O)N(c4ccc(Cl)cc4)C3)c2c1
    InChI
    InChI=1S/C22H22ClN3O3/c1-29-18-6-7-20-19(11-18)14(12-25-20)8-9-24-22(28)15-10-21(27)26(13-15)17-4-2-16(23)3-5-17/h2-7,11-12,15,25H,8-10,13H2,1H3,(H,24,28)
    MOLECULAR FORMULA
    C22H22ClN3O3
    CROSS REFERENCES
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    canSAR1725104

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.13
    AlogP 3.54
    HBond donors 2
    HBond acceptors 6
    Atoms 51
    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 canSAR1725104.