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canSAR1832039
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NAMES
    SMILES
    O=c1c(Cl)c(N2CCC3(CC2)OCCO3)cnn1C12CC3CC(CC(C3)C1)C2
    InChI
    InChI=1S/C21H28ClN3O3/c22-18-17(24-3-1-21(2-4-24)27-5-6-28-21)13-23-25(19(18)26)20-10-14-7-15(11-20)9-16(8-14)12-20/h13-16H,1-12H2
    MOLECULAR FORMULA
    C21H28ClN3O3
    CROSS REFERENCES
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    canSAR1832039

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 405.18
    AlogP 3.17
    HBond donors 0
    HBond acceptors 6
    Atoms 56
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1832039.