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canSAR342664
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NAMES
    SMILES
    CC1(NCC(=O)N2CCC[C@H]2C#N)CCN(c2cc(C(=O)O)ccn2)CC1
    InChI
    InChI=1S/C19H25N5O3/c1-19(22-13-17(25)24-8-2-3-15(24)12-20)5-9-23(10-6-19)16-11-14(18(26)27)4-7-21-16/h4,7,11,15,22H,2-3,5-6,8-10,13H2,1H3,(H,26,27)/t15-/m0/s1
    MOLECULAR FORMULA
    C19H25N5O3
    CROSS REFERENCES
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    canSAR342664

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 371.20
    AlogP 1.24
    HBond donors 2
    HBond acceptors 8
    Atoms 52
    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 canSAR342664.