canSAR2094449
FEATURES
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NAMES
    SMILES
    CCCCCCCCNC(=O)[C@H](Cc1ccc(OCc2cccc3ccccc23)cc1)NC(=O)[C@H]1CC[C@H](CN)CC1
    InChI
    InChI=1S/C36H49N3O3/c1-2-3-4-5-6-9-23-38-36(41)34(39-35(40)30-19-15-28(25-37)16-20-30)24-27-17-21-32(22-18-27)42-26-31-13-10-12-29-11-7-8-14-33(29)31/h7-8,10-14,17-18,21-22,28,30,34H,2-6,9,15-16,19-20,23-26,37H2,1H3,(H,38,41)(H,39,40)/t28-,30-,34-/m0/s1
    MOLECULAR FORMULA
    C36H49N3O3
    CROSS REFERENCES
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    canSAR2094449
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight571.38
    AlogP6.69
    HBond donors4
    HBond acceptors6
    Atoms91
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2094449.