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canSAR1973082
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NAMES
    SMILES
    C[C@@H](N)c1ccc(-c2cc3ncn(C)c(=O)c3c(NCCCO)n2)cc1
    InChI
    InChI=1S/C19H23N5O2/c1-12(20)13-4-6-14(7-5-13)15-10-16-17(19(26)24(2)11-22-16)18(23-15)21-8-3-9-25/h4-7,10-12,25H,3,8-9,20H2,1-2H3,(H,21,23)/t12-/m1/s1
    MOLECULAR FORMULA
    C19H23N5O2
    CROSS REFERENCES
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    canSAR1973082

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.19
    AlogP 1.81
    HBond donors 4
    HBond acceptors 7
    Atoms 49
    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 canSAR1973082.