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canSAR1014258
FEATURES
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NAMES
    SMILES
    COc1cc2c(cc1OCCCCCCN1C(=O)c3cccc4cccc1c34)N=C[C@@H]1CCCN1C2=O
    InChI
    InChI=1S/C30H31N3O4/c1-36-26-17-23-24(31-19-21-11-8-15-32(21)30(23)35)18-27(26)37-16-5-3-2-4-14-33-25-13-7-10-20-9-6-12-22(28(20)25)29(33)34/h6-7,9-10,12-13,17-19,21H,2-5,8,11,14-16H2,1H3/t21-/m0/s1
    MOLECULAR FORMULA
    C30H31N3O4
    CROSS REFERENCES
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    canSAR1014258

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 497.23
    AlogP 5.77
    HBond donors 0
    HBond acceptors 7
    Atoms 68
    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 canSAR1014258.