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canSAR1090223
FEATURES
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NAMES
    SMILES
    COC1COCCC1N[C@@H]1C[C@H]2CCC[C@@]2(C(=O)N2CCc3ncc(Cl)cc3C2)C1
    InChI
    InChI=1S/C23H32ClN3O3/c1-29-21-14-30-8-5-20(21)26-18-10-16-3-2-6-23(16,11-18)22(28)27-7-4-19-15(13-27)9-17(24)12-25-19/h9,12,16,18,20-21,26H,2-8,10-11,13-14H2,1H3/t16-,18-,20?,21?,23-/m1/s1
    MOLECULAR FORMULA
    C23H32ClN3O3
    CROSS REFERENCES
    1090223 logo

    canSAR1090223

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 433.21
    AlogP 2.96
    HBond donors 1
    HBond acceptors 6
    Atoms 62
    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 canSAR1090223.