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canSAR1619885
FEATURES
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NAMES
    SMILES
    C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O
    InChI
    InChI=1S/C29H33ClN4O6S/c1-19-16-34(20(2)18-35)28(36)24-10-7-11-25(32-29(37)31-22-8-5-4-6-9-22)27(24)40-26(19)17-33(3)41(38,39)23-14-12-21(30)13-15-23/h4-15,19-20,26,35H,16-18H2,1-3H3,(H2,31,32,37)/t19-,20+,26+/m1/s1
    MOLECULAR FORMULA
    C29H33ClN4O6S
    CROSS REFERENCES
    1619885 logo

    canSAR1619885

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 600.18
    AlogP 4.52
    HBond donors 3
    HBond acceptors 10
    Atoms 74
    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 canSAR1619885.