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canSAR791888
FEATURES
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NAMES
    SMILES
    C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(C(=O)C2CC2)cc1)C(=O)O
    InChI
    InChI=1S/C22H29N3O5/c1-14(21(27)28)23-22(29)25-13-17-11-18(25)12-24(17)9-2-10-30-19-7-5-16(6-8-19)20(26)15-3-4-15/h5-8,14-15,17-18H,2-4,9-13H2,1H3,(H,23,29)(H,27,28)/t14-,17-,18-/m0/s1
    MOLECULAR FORMULA
    C22H29N3O5
    CROSS REFERENCES
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    canSAR791888

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 415.21
    AlogP 1.99
    HBond donors 2
    HBond acceptors 8
    Atoms 59
    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 canSAR791888.