canSAR2080371
FEATURES
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NAMES
    SMILES
    NCCCC[C@H](NC(=O)[C@H](Cc1ccc(OP(=O)(O)O)cc1)NC(=O)c1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(N)=O
    InChI
    InChI=1S/C36H45N6O9P/c37-20-8-7-14-28(36(47)42-21-9-15-31(42)35(46)40-29(32(38)43)22-24-10-3-1-4-11-24)39-34(45)30(41-33(44)26-12-5-2-6-13-26)23-25-16-18-27(19-17-25)51-52(48,49)50/h1-6,10-13,16-19,28-31H,7-9,14-15,20-23,37H2,(H2,38,43)(H,39,45)(H,40,46)(H,41,44)(H2,48,49,50)/t28-,29-,30-,31-/m0/s1
    MOLECULAR FORMULA
    C36H45N6O9P
    CROSS REFERENCES
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    canSAR2080371
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight736.30
    AlogP1.32
    HBond donors9
    HBond acceptors15
    Atoms97
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080371.