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canSAR1972889
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NAMES
    SMILES
    N#Cc1ccc(C2CCN(C(=O)c3cc(-c4nc5cc(N6CCCC6)ncc5[nH]4)ccc3Cl)CC2)cc1
    InChI
    InChI=1S/C29H27ClN6O/c30-24-8-7-22(28-33-25-16-27(32-18-26(25)34-28)35-11-1-2-12-35)15-23(24)29(37)36-13-9-21(10-14-36)20-5-3-19(17-31)4-6-20/h3-8,15-16,18,21H,1-2,9-14H2,(H,33,34)
    MOLECULAR FORMULA
    C29H27ClN6O
    CROSS REFERENCES
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    canSAR1972889

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 510.19
    AlogP 5.77
    HBond donors 1
    HBond acceptors 7
    Atoms 64
    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 canSAR1972889.