canSAR542820
FEATURES
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NAMES
    SMILES
    Cl.NCCNCCNc1ccc2c3c(nn2CCO)-c2c(O)ccc(O)c2C(=O)c13
    InChI
    InChI=1S/C20H23N5O4.ClH/c21-5-6-22-7-8-23-11-1-2-12-16-15(11)20(29)18-14(28)4-3-13(27)17(18)19(16)24-25(12)9-10-26;/h1-4,22-23,26-28H,5-10,21H2;1H
    MOLECULAR FORMULA
    C20H24ClN5O4
    CROSS REFERENCES
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    canSAR542820
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight433.15
    AlogP1.03
    HBond donors7
    HBond acceptors9
    Atoms54
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR542820.