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canSAR840530
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NAMES
    SMILES
    CC(=O)N[C@H]1CCCN2c3cc(Cl)ccc3Oc3ccccc3[C@H]12
    InChI
    InChI=1S/C19H19ClN2O2/c1-12(23)21-15-6-4-10-22-16-11-13(20)8-9-18(16)24-17-7-3-2-5-14(17)19(15)22/h2-3,5,7-9,11,15,19H,4,6,10H2,1H3,(H,21,23)/t15-,19+/m0/s1
    MOLECULAR FORMULA
    C19H19ClN2O2
    CROSS REFERENCES
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    canSAR840530

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 342.11
    AlogP 4.29
    HBond donors 1
    HBond acceptors 4
    Atoms 43
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR840530.