UCSF

ZINC39762844

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 33 Yes

Popular Name: 2-[[5-[2-(3-chloroanilino)-2-oxo-ethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,3,4-thia 2-[[5-[2-(3-chloroanilino)-2-oxo…

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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) 2.63 10.51 -29.75 2 9 0 115 500.009 8 ↓
Hi High (pH 8-9.5) 2.81 9.31 -63.6 1 9 -1 121 499.001 8 ↓

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