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canSAR2203994
FEATURES
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NAMES
    SMILES
    CN[C@@H](C)C(=O)N[C@H]1CN(C(=O)c2ccc(C(C)=O)cc2)c2ccccc2N(Cc2c(OC)ccc3c(Br)cccc23)C1=O
    InChI
    InChI=1S/C34H33BrN4O5/c1-20(36-3)32(41)37-28-19-39(33(42)23-14-12-22(13-15-23)21(2)40)30-11-6-5-10-29(30)38(34(28)43)18-26-24-8-7-9-27(35)25(24)16-17-31(26)44-4/h5-17,20,28,36H,18-19H2,1-4H3,(H,37,41)/t20-,28-/m0/s1
    MOLECULAR FORMULA
    C34H33BrN4O5
    CROSS REFERENCES
    2203994 logo

    canSAR2203994

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 656.16
    AlogP 5.10
    HBond donors 2
    HBond acceptors 9
    Atoms 77
    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 canSAR2203994.