canSAR823767
FEATURES
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NAMES
    SMILES
    CCCC1(CCC)CNC(=O)[C@@H](Cc2ccc(OC)c(Cl)c2)NC(=O)/C=C/C[C@@H]([C@H](C)[C@@H](O)[C@@H](Cl)c2ccccc2)OC(=O)[C@H](CC(C)C)OC1=O
    InChI
    InChI=1S/C40H54Cl2N2O8/c1-7-19-40(20-8-2)24-43-37(47)30(23-27-17-18-32(50-6)29(41)22-27)44-34(45)16-12-15-31(51-38(48)33(21-25(3)4)52-39(40)49)26(5)36(46)35(42)28-13-10-9-11-14-28/h9-14,16-18,22,25-26,30-31,33,35-36,46H,7-8,15,19-21,23-24H2,1-6H3,(H,43,47)(H,44,45)/b16-12+/t26-,30+,31-,33-,35-,36+/m0/s1
    MOLECULAR FORMULA
    C40H54Cl2N2O8
    CROSS REFERENCES
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    canSAR823767
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight760.33
    AlogP6.89
    HBond donors3
    HBond acceptors10
    Atoms106
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823767.