canSAR1503040
FEATURES
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NAMES
    SMILES
    CN(C)C(=O)c1cccc(-c2cccc(-c3nc(C(=O)NC4CCCCC4)cc4c3[C@H](CCO)N([S@@](=O)C(C)(C)C)C4)c2)c1
    InChI
    InChI=1S/C35H44N4O4S/c1-35(2,3)44(43)39-22-27-21-29(33(41)36-28-15-7-6-8-16-28)37-32(31(27)30(39)17-18-40)25-13-9-11-23(19-25)24-12-10-14-26(20-24)34(42)38(4)5/h9-14,19-21,28,30,40H,6-8,15-18,22H2,1-5H3,(H,36,41)/t30-,44-/m0/s1
    MOLECULAR FORMULA
    C35H44N4O4S
    CROSS REFERENCES
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    canSAR1503040
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight616.31
    AlogP5.88
    HBond donors2
    HBond acceptors8
    Atoms88
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1503040.