UCSF

ZINC27526163

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2009 24 No

Popular Name: (E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-[(1S,2S)-2-hydroxy-1-methyl-propyl]oxiran-2-yl]meth (E)-4-[(2S,3R,4R,5S)-3,4-dihydro…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.60 -2.19 -68.36 3 7 -1 123 343.396 7 ↓
Lo Low (pH 4.5-6) 0.60 -3.29 -19.18 4 7 0 120 344.404 7 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4102901; US4102904; US4152337; US4166863; US4217447; US4217448; US4235784; US4237161; US4256762; US4256879; US4267316; US4283411; US4283412; US4289779; US4318856; US4465689 IBM Patent Data

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Analogs ( Draw Identity 99% 90% 80% 70% )