canSAR736514
FEATURES
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NAMES
    SMILES
    CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](O)C(C)C)S(=O)(=O)c1ccc2ncsc2c1
    InChI
    InChI=1S/C26H35N3O5S2/c1-17(2)14-29(36(33,34)20-10-11-21-24(13-20)35-16-27-21)15-23(30)22(12-19-8-6-5-7-9-19)28-26(32)25(31)18(3)4/h5-11,13,16-18,22-23,25,30-31H,12,14-15H2,1-4H3,(H,28,32)/t22-,23+,25-/m0/s1
    MOLECULAR FORMULA
    C26H35N3O5S2
    CROSS REFERENCES
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    canSAR736514
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight533.20
    AlogP3.05
    HBond donors3
    HBond acceptors8
    Atoms71
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR736514.