UCSF

ZINC67028429

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 4th, 2011 24 No

Popular Name: 2,2,2-trifluoro-1-[(4R,5S,6S)-6-hydroxy-1-methyl-4-thiazol-4-yl-2-thioxo-6-(trifluoromethyl)hexahydr 2,2,2-trifluoro-1-[(4R,5S,6S)-6-…

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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) 1.95 2.74 -10.78 2 5 0 65 393.334 4 ↓
Mid Mid (pH 6-8) 1.95 3.22 -33.24 1 5 -1 68 392.326 4 ↓

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

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