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canSAR1596049
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NAMES
    SMILES
    Cc1ccc(-n2nc3c(N4CCCC(C(=O)NCc5ccc(Cl)cc5)C4)nnc(C)c3c2C)cc1
    InChI
    InChI=1S/C27H29ClN6O/c1-17-6-12-23(13-7-17)34-19(3)24-18(2)30-31-26(25(24)32-34)33-14-4-5-21(16-33)27(35)29-15-20-8-10-22(28)11-9-20/h6-13,21H,4-5,14-16H2,1-3H3,(H,29,35)
    MOLECULAR FORMULA
    C27H29ClN6O
    CROSS REFERENCES
    1596049 logo

    canSAR1596049

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 488.21
    AlogP 4.93
    HBond donors 1
    HBond acceptors 7
    Atoms 64
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1596049.