canSAR1087386
FEATURES
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NAMES
    SMILES
    CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](OC(=O)NCCCCNC(=O)c3ccc(OC)cc3)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](OC(=O)NCc2ccc(F)cc2)[C@]1(C)O
    InChI
    InChI=1S/C59H94FN5O16/c1-16-45-59(10,72)50(80-56(70)63-32-40-19-23-42(60)24-20-40)38(6)65(13)33-34(2)30-57(8,71)49(79-54-47(66)44(64(11)12)29-35(3)75-54)36(4)48(37(5)53(68)77-45)78-46-31-58(9,74-15)51(39(7)76-46)81-55(69)62-28-18-17-27-61-52(67)41-21-25-43(73-14)26-22-41/h19-26,34-39,44-51,54,66,71-72H,16-18,27-33H2,1-15H3,(H,61,67)(H,62,69)(H,63,70)/t34-,35-,36+,37-,38-,39+,44+,45-,46+,47-,48+,49-,50-,51+,54+,57-,58-,59-/m1/s1
    MOLECULAR FORMULA
    C59H94FN5O16
    CROSS REFERENCES
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    canSAR1087386
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1147.67
    AlogP5.93
    HBond donors6
    HBond acceptors21
    Atoms175
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087386.