canSAR1746408
FEATURES
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NAMES
    SMILES
    CCOc1ccc(N2C(=O)NC(=O)/C(=C\NCCCn3ccnc3)C2=O)cc1
    InChI
    InChI=1S/C19H21N5O4/c1-2-28-15-6-4-14(5-7-15)24-18(26)16(17(25)22-19(24)27)12-20-8-3-10-23-11-9-21-13-23/h4-7,9,11-13,20H,2-3,8,10H2,1H3,(H,22,25,27)/b16-12+
    MOLECULAR FORMULA
    C19H21N5O4
    CROSS REFERENCES
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    canSAR1746408
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight383.16
    AlogP1.43
    HBond donors2
    HBond acceptors9
    Atoms49
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746408.