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canSAR1122799
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NAMES
    SMILES
    CC(C)(C)n1nnnc1C(NCCNc1ccnc2cc(Cl)ccc12)c1ccc(Cl)cc1
    InChI
    InChI=1S/C23H25Cl2N7/c1-23(2,3)32-22(29-30-31-32)21(15-4-6-16(24)7-5-15)28-13-12-27-19-10-11-26-20-14-17(25)8-9-18(19)20/h4-11,14,21,28H,12-13H2,1-3H3,(H,26,27)
    MOLECULAR FORMULA
    C23H25Cl2N7
    CROSS REFERENCES
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    canSAR1122799

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 469.15
    AlogP 5.07
    HBond donors 2
    HBond acceptors 7
    Atoms 57
    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 canSAR1122799.