canSAR2157164
FEATURES
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NAMES
    SMILES
    Cc1nc(N)cc2c1CNC(=O)c1cnn(c1)Cc1ccc(Cn3cccn3)cc1OCC/C=C/CCO2
    InChI
    InChI=1S/C28H31N7O3/c1-20-24-16-30-28(36)23-15-32-35(19-23)18-22-8-7-21(17-34-10-6-9-31-34)13-25(22)37-11-4-2-3-5-12-38-26(24)14-27(29)33-20/h2-3,6-10,13-15,19H,4-5,11-12,16-18H2,1H3,(H2,29,33)(H,30,36)/b3-2+
    MOLECULAR FORMULA
    C28H31N7O3
    CROSS REFERENCES
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    canSAR2157164
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight513.25
    AlogP3.50
    HBond donors3
    HBond acceptors10
    Atoms69
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2157164.