canSAR1529461
FEATURES
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NAMES
    SMILES
    CC(C)(C)OC(=O)[C@H](CCCC[NH3+])NC(=O)c1[nH]cnc1C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1.[Cl-]
    InChI
    InChI=1S/C31H39N5O6.ClH/c1-31(2,3)42-30(40)23(16-10-11-17-32)35-27(37)25-26(34-20-33-25)28(38)36-24(18-21-12-6-4-7-13-21)29(39)41-19-22-14-8-5-9-15-22;/h4-9,12-15,20,23-24H,10-11,16-19,32H2,1-3H3,(H,33,34)(H,35,37)(H,36,38);1H/t23-,24-;/m0./s1
    MOLECULAR FORMULA
    C31H40ClN5O6
    CROSS REFERENCES
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    canSAR1529461
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight613.27
    AlogP-0.65
    HBond donors6
    HBond acceptors11
    Atoms83
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1529461.