canSAR1417703
FEATURES
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NAMES
    SMILES
    Cl.Cl.Clc1cccc2c1C(/C=N/NC1=NCCN1)c1ccccc1C2/C=N/NC1=NCCN1
    InChI
    InChI=1S/C22H23ClN8.2ClH/c23-19-7-3-6-16-17(12-28-30-21-24-8-9-25-21)14-4-1-2-5-15(14)18(20(16)19)13-29-31-22-26-10-11-27-22;;/h1-7,12-13,17-18H,8-11H2,(H2,24,25,30)(H2,26,27,31);2*1H/b28-12+,29-13+;;
    MOLECULAR FORMULA
    C22H25Cl3N8
    CROSS REFERENCES
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    canSAR1417703
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight506.13
    AlogP2.83
    HBond donors4
    HBond acceptors8
    Atoms58
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417703.