UCSF

ZINC60021335

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 36 No

Popular Name: (6S,7S)-8-oxo-3-[[1-[2-(sulfomethylamino)ethyl]tetrazol-5-yl]sulfanylmethyl]-7-[[2-(2-thienyl)acetyl (6S,7S)-8-oxo-3-[[1-[2-(sulfomet…

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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) -2.73 2.58 -100.75 3 14 -1 207 574.668 12 ↓
Mid Mid (pH 6-8) -2.73 1.1 -111.67 2 14 -2 202 573.66 12 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4205166 IBM Patent Data

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

No pre-computed analogs available. Try a structural similarity search.