canSAR171088
FEATURES
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NAMES
    SMILES
    CC[C@H]1OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(OC)C[C@@H](C)/C(=N\OCCNCC2CCC(CNCc3ccc(Oc4ccccc4)cc3)CC2)[C@H](C)[C@@H](O)[C@]1(C)O
    InChI
    InChI=1S/C53H84N4O11/c1-12-44-53(8,62)48(60)35(4)45(33(2)29-52(7,63-11)49(36(5)46(58)37(6)50(61)67-44)68-51-47(59)43(57(9)10)28-34(3)65-51)56-64-27-26-54-30-38-18-20-39(21-19-38)31-55-32-40-22-24-42(25-23-40)66-41-16-14-13-15-17-41/h13-17,22-25,33-39,43-44,47-49,51,54-55,59-60,62H,12,18-21,26-32H2,1-11H3/b56-45+/t33-,34-,35+,36+,37-,38?,39?,43+,44-,47-,48-,49-,51+,52+,53-/m1/s1
    MOLECULAR FORMULA
    C53H84N4O11
    CROSS REFERENCES
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    canSAR171088
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight952.61
    AlogP6.50
    HBond donors5
    HBond acceptors15
    Atoms152
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR171088.