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canSAR1618842
FEATURES
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NAMES
    SMILES
    COC(=O)[C@@]12C[C@@H](CC(=O)NCc3ccc(C)o3)C(=O)N(Cc3ccc4c(c3)OCO4)C1=CCC(C)(C)C2
    InChI
    InChI=1S/C29H34N2O7/c1-18-5-7-21(38-18)14-30-25(32)12-20-13-29(27(34)35-4)16-28(2,3)10-9-24(29)31(26(20)33)15-19-6-8-22-23(11-19)37-17-36-22/h5-9,11,20H,10,12-17H2,1-4H3,(H,30,32)/t20-,29-/m1/s1
    MOLECULAR FORMULA
    C29H34N2O7
    CROSS REFERENCES
    1618842 logo

    canSAR1618842

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 522.24
    AlogP 4.24
    HBond donors 1
    HBond acceptors 9
    Atoms 72
    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 canSAR1618842.