canSAR288852
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)CCCCC1CCSS1)C(=O)NC(Cc1ccc(Br)cc1)C(=O)C(=O)NC(C)(C)C
    InChI
    InChI=1S/C28H42BrN3O4S2/c1-18(2)16-23(30-24(33)9-7-6-8-21-14-15-37-38-21)26(35)31-22(17-19-10-12-20(29)13-11-19)25(34)27(36)32-28(3,4)5/h10-13,18,21-23H,6-9,14-17H2,1-5H3,(H,30,33)(H,31,35)(H,32,36)/t21?,22?,23-/m0/s1
    MOLECULAR FORMULA
    C28H42BrN3O4S2
    CROSS REFERENCES
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    canSAR288852
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight627.18
    AlogP5.21
    HBond donors3
    HBond acceptors7
    Atoms80
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR288852.