UCSF

ZINC13274821

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2008 29 Yes

Popular Name: 4-[[2-[[6-(2-carboxyethyl)-5-oxo-4H-1,2,4-triazin-3-yl]sulfanyl]acetyl]amino]-5-chloro-2-methoxy-ben 4-[[2-[[6-(2-carboxyethyl)-5-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) 1.84 3.99 -164.17 1 11 -3 180 439.813 9 ↓
Lo Low (pH 4.5-6) 1.38 5.48 -103.88 2 11 -2 177 440.821 9 ↓

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

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