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canSAR1429006
FEATURES
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NAMES
    SMILES
    CCC[C@@H]([C@H](CC(C)C)C(=O)N[C@@H](C(=O)Nc1nccs1)C(C)(C)SCCNC(=O)OCC)N(O)C=O
    InChI
    InChI=1S/C24H41N5O6S2/c1-7-9-18(29(34)15-30)17(14-16(3)4)20(31)27-19(21(32)28-22-25-10-12-36-22)24(5,6)37-13-11-26-23(33)35-8-2/h10,12,15-19,34H,7-9,11,13-14H2,1-6H3,(H,26,33)(H,27,31)(H,25,28,32)
    MOLECULAR FORMULA
    C24H41N5O6S2
    CROSS REFERENCES
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    canSAR1429006

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 559.25
    AlogP 3.50
    HBond donors 4
    HBond acceptors 11
    Atoms 78
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1429006.