canSAR160298
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H]1NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(=O)O)NC(=O)[C@H](Cc2c(Br)[nH]c3ccccc23)NC1=O
    InChI
    InChI=1S/C31H41BrN6O7/c1-15(2)12-20-27(41)34-21(13-18-17-8-5-6-9-19(17)33-26(18)32)28(42)36-22(14-24(39)40)31(45)38-11-7-10-23(38)29(43)37-25(16(3)4)30(44)35-20/h5-6,8-9,15-16,20-23,25,33H,7,10-14H2,1-4H3,(H,34,41)(H,35,44)(H,36,42)(H,37,43)(H,39,40)/t20-,21+,22-,23?,25+/m1/s1
    MOLECULAR FORMULA
    C31H41BrN6O7
    CROSS REFERENCES
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    canSAR160298
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight688.22
    AlogP1.59
    HBond donors6
    HBond acceptors13
    Atoms86
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR160298.