UCSF

ZINC39763641

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 35 Yes

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

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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) 2.39 9.96 -28.3 2 10 0 124 509.617 9 ↓
Hi High (pH 8-9.5) 2.58 8.42 -60.17 1 10 -1 130 508.609 9 ↓

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