UCSF

ZINC39762429

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 34 Yes

Popular Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-[2-(4-fluoroanilino)-2-oxo-ethyl]-4-phenyl-1,2,4-triazol-3-y N-(5-ethyl-1,3,4-thiadiazol-2-yl…

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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) 2.71 10.83 -27.98 2 9 0 115 497.581 9 ↓
Hi High (pH 8-9.5) 2.90 9.61 -61.4 1 9 -1 121 496.573 9 ↓

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