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canSAR790762
FEATURES
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NAMES
    SMILES
    Oc1ccc([C@@H]2N=CN[C@@H]2c2ccc(OCCN3CCCCC3)cc2Cl)c(Cl)c1
    InChI
    InChI=1S/C22H25Cl2N3O2/c23-19-12-15(28)4-6-17(19)21-22(26-14-25-21)18-7-5-16(13-20(18)24)29-11-10-27-8-2-1-3-9-27/h4-7,12-14,21-22,28H,1-3,8-11H2,(H,25,26)/t21-,22+/m0/s1
    MOLECULAR FORMULA
    C22H25Cl2N3O2
    CROSS REFERENCES
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    canSAR790762

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 433.13
    AlogP 4.98
    HBond donors 2
    HBond acceptors 5
    Atoms 54
    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 canSAR790762.