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canSAR2094022
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NAMES
    SMILES
    C[C@H]1CCCCN1c1nc2cc(C(=O)O)ccc2nc1-c1ccc2[nH]ccc2c1
    InChI
    InChI=1S/C23H22N4O2/c1-14-4-2-3-11-27(14)22-21(16-5-7-18-15(12-16)9-10-24-18)25-19-8-6-17(23(28)29)13-20(19)26-22/h5-10,12-14,24H,2-4,11H2,1H3,(H,28,29)/t14-/m0/s1
    MOLECULAR FORMULA
    C23H22N4O2
    CROSS REFERENCES
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    canSAR2094022

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 386.17
    AlogP 4.86
    HBond donors 2
    HBond acceptors 6
    Atoms 51
    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 canSAR2094022.