canSAR1932457
FEATURES
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NAMES
    SMILES
    COCCOCCNC(=O)OCOC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@](C#N)(c3ccc(Cl)cc3F)[C@H]2c2cccc(Cl)c2F)c(OC)c1
    InChI
    InChI=1S/C38H42Cl2F2N4O8/c1-37(2,3)19-30-38(20-43,25-11-10-23(39)18-27(25)41)31(24-7-6-8-26(40)32(24)42)33(46-30)34(47)45-28-12-9-22(17-29(28)51-5)35(48)53-21-54-36(49)44-13-14-52-16-15-50-4/h6-12,17-18,30-31,33,46H,13-16,19,21H2,1-5H3,(H,44,49)(H,45,47)/t30-,31-,33+,38-/m0/s1
    MOLECULAR FORMULA
    C38H42Cl2F2N4O8
    CROSS REFERENCES
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    canSAR1932457
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight790.23
    AlogP6.74
    HBond donors3
    HBond acceptors12
    Atoms96
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1932457.