UCSF

ZINC55485187

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2010 29 No

Popular Name: 8-[2-(3,4-dimethylphenyl)sulfanylpyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-[2-(3,4-dimethylphenyl)sulfany…

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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) 1.99 5.55 -18.2 2 7 0 91 410.499 3 ↓
Hi High (pH 8-9.5) 2.18 2.9 -50.96 1 7 -1 98 409.491 3 ↓

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

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