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canSAR67215
FEATURES
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NAMES
    SMILES
    CNC(=O)C1CC(OC(C)=O)C(n2cnc3c(NC(=O)c4cccc(I)c4)nc(Cl)nc32)O1
    InChI
    InChI=1S/C20H18ClIN6O5/c1-9(29)32-13-7-12(18(31)23-2)33-19(13)28-8-24-14-15(26-20(21)27-16(14)28)25-17(30)10-4-3-5-11(22)6-10/h3-6,8,12-13,19H,7H2,1-2H3,(H,23,31)(H,25,26,27,30)
    MOLECULAR FORMULA
    C20H18ClIN6O5
    CROSS REFERENCES
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    canSAR67215

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 584.01
    AlogP 2.30
    HBond donors 2
    HBond acceptors 11
    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 canSAR67215.