canSAR823670
FEATURES
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NAMES
    SMILES
    N[C@@H]1[C@@H](O)C[C@](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](CO)O[C@@H](OCCCCCSCCCCCC(=O)NCCC[Si](CCCNC(=O)CCCCCSCCCCCO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O[C@]6(C(=O)O)C[C@H](O)[C@@H](N)[C@H]([C@H](O)[C@H](O)CO)O6)[C@H]5O)[C@H](O)[C@H]4O)(CCCNC(=O)CCCCCSCCCCCO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O[C@]6(C(=O)O)C[C@H](O)[C@@H](N)[C@H]([C@H](O)[C@H](O)CO)O6)[C@H]5O)[C@H](O)[C@H]4O)CCCNC(=O)CCCCCSCCCCCO[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O[C@]6(C(=O)O)C[C@H](O)[C@@H](N)[C@H]([C@H](O)[C@H](O)CO)O6)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@@H]2O)(C(=O)O)O[C@H]1[C@H](O)[C@H](O)CO
    InChI
    InChI=1S/C140H252N8O76S4Si/c141-89-69(161)53-137(133(193)194,217-117(89)93(173)73(165)57-149)221-121-97(177)77(61-153)205-129(109(121)189)213-113-81(65-157)209-125(105(185)101(113)181)201-37-13-5-21-45-225-41-17-1-9-29-85(169)145-33-25-49-229(50-26-34-146-86(170)30-10-2-18-42-226-46-22-6-14-38-202-126-106(186)102(182)114(82(66-158)210-126)214-130-110(190)122(98(178)78(62-154)206-130)222-138(134(195)196)54-70(162)90(142)118(218-138)94(174)74(166)58-150,51-27-35-147-87(171)31-11-3-19-43-227-47-23-7-15-39-203-127-107(187)103(183)115(83(67-159)211-127)215-131-111(191)123(99(179)79(63-155)207-131)223-139(135(197)198)55-71(163)91(143)119(219-139)95(175)75(167)59-151)52-28-36-148-88(172)32-12-4-20-44-228-48-24-8-16-40-204-128-108(188)104(184)116(84(68-160)212-128)216-132-112(192)124(100(180)80(64-156)208-132)224-140(136(199)200)56-72(164)92(144)120(220-140)96(176)76(168)60-152/h69-84,89-132,149-168,173-192H,1-68,141-144H2,(H,145,169)(H,146,170)(H,147,171)(H,148,172)(H,193,194)(H,195,196)(H,197,198)(H,199,200)/t69-,70-,71-,72-,73+,74+,75+,76+,77+,78+,79+,80+,81+,82+,83+,84+,89+,90+,91+,92+,93+,94+,95+,96+,97-,98-,99-,100-,101+,102+,103+,104+,105+,106+,107+,108+,109+,110+,111+,112+,113+,114+,115+,116+,117+,118+,119+,120+,121-,122-,123-,124-,125+,126+,127+,128+,129-,130-,131-,132-,137-,138-,139-,140-/m0/s1
    MOLECULAR FORMULA
    C140H252N8O76S4Si
    CROSS REFERENCES
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    canSAR823670
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight3417.48
    AlogP-18.14
    HBond donors56
    HBond acceptors84
    Atoms481
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823670.