canSAR1846598
FEATURES
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NAMES
    SMILES
    CCOP(=O)(OCC)OC[C@H](CC)Nc1ncc(C)c(-c2c[nH]c(C(=O)N[C@H](COP(=O)(OCC)OCC)c3cccc(Cl)c3)c2)n1
    InChI
    InChI=1S/C30H44ClN5O9P2/c1-7-25(19-44-46(38,40-8-2)41-9-3)34-30-33-17-21(6)28(36-30)23-16-26(32-18-23)29(37)35-27(22-13-12-14-24(31)15-22)20-45-47(39,42-10-4)43-11-5/h12-18,25,27,32H,7-11,19-20H2,1-6H3,(H,35,37)(H,33,34,36)/t25-,27+/m0/s1
    MOLECULAR FORMULA
    C30H44ClN5O9P2
    CROSS REFERENCES
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    canSAR1846598
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight715.23
    AlogP7.49
    HBond donors3
    HBond acceptors14
    Atoms91
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846598.