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canSAR1092243
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NAMES
    SMILES
    O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)N1CCN(Cc2ccc(Cl)c(Cl)c2)CC1
    InChI
    InChI=1S/C25H33Cl2N3O2/c26-21-2-1-17(10-22(21)27)16-29-3-5-30(6-4-29)24(32)15-28-23(31)14-25-11-18-7-19(12-25)9-20(8-18)13-25/h1-2,10,18-20H,3-9,11-16H2,(H,28,31)
    MOLECULAR FORMULA
    C25H33Cl2N3O2
    CROSS REFERENCES
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    canSAR1092243

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 477.19
    AlogP 4.36
    HBond donors 1
    HBond acceptors 5
    Atoms 65
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1092243.