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canSAR652742
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NAMES
    SMILES
    O=C(NCC1CCCCC1)c1nn(-c2ccccc2Cl)c(-c2ccc(Cl)cc2)c1Cn1cncn1
    InChI
    InChI=1S/C26H26Cl2N6O/c27-20-12-10-19(11-13-20)25-21(15-33-17-29-16-31-33)24(26(35)30-14-18-6-2-1-3-7-18)32-34(25)23-9-5-4-8-22(23)28/h4-5,8-13,16-18H,1-3,6-7,14-15H2,(H,30,35)
    MOLECULAR FORMULA
    C26H26Cl2N6O
    CROSS REFERENCES
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    canSAR652742

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 508.15
    AlogP 5.80
    HBond donors 1
    HBond acceptors 7
    Atoms 61
    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 canSAR652742.