canSAR703036
FEATURES
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NAMES
    SMILES
    COc1ccc2nc3cc(Cl)ccc3c(NCCCNCCCNCCn3cnc4c(N)ncnc43)c2c1
    InChI
    InChI=1S/C27H32ClN9O/c1-38-19-5-7-22-21(15-19)24(20-6-4-18(28)14-23(20)36-22)32-11-3-10-30-8-2-9-31-12-13-37-17-35-25-26(29)33-16-34-27(25)37/h4-7,14-17,30-31H,2-3,8-13H2,1H3,(H,32,36)(H2,29,33,34)
    MOLECULAR FORMULA
    C27H32ClN9O
    CROSS REFERENCES
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    canSAR703036
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight533.24
    AlogP3.84
    HBond donors5
    HBond acceptors10
    Atoms70
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR703036.