UCSF

ZINC33823821

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 23 Yes

Popular Name: 3-Quinuclidinol, alpha,alpha-(2-thienyl)glycolate (ester), hydrochloride; Glycolic acid, alpha,alpha-(2-dithienyl)-, 3-quinuclidinyl ester, hydrochloride; LS-72919; Quinuclidine, 3-((alpha,alpha-di-2-thienylglycoloyl)oxy)-, hydrochloride; alpha,alpha-(2-D 3-Quinuclidinol, alpha,alpha-(2-…

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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) 2.62 8.48 -44.26 2 4 1 51 350.485 5 ↓
Hi High (pH 8-9.5) 2.62 6.05 -10.35 1 4 0 50 349.477 5 ↓
Hi High (pH 8-9.5) 2.62 9.12 -57.35 1 4 0 54 349.477 5 ↓

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