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canSAR846813
FEATURES
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NAMES
    SMILES
    Cc1cc2cc(N/C(=N\C#N)N[C@H]3CCCCN(CC(=O)N4CC5CC5C4)C3=O)ccc2o1
    InChI
    InChI=1S/C24H28N6O3/c1-15-8-16-10-19(5-6-21(16)33-15)27-24(26-14-25)28-20-4-2-3-7-29(23(20)32)13-22(31)30-11-17-9-18(17)12-30/h5-6,8,10,17-18,20H,2-4,7,9,11-13H2,1H3,(H2,26,27,28)/t17?,18?,20-/m0/s1
    MOLECULAR FORMULA
    C24H28N6O3
    CROSS REFERENCES
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    canSAR846813

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.22
    AlogP 2.44
    HBond donors 2
    HBond acceptors 9
    Atoms 61
    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 canSAR846813.