UCSF

ZINC62027004

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2011 25 Yes

Popular Name: N-[2-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)ethyl]-2-oxo-3H-1,3-benzoxazole-6-sulfon N-[2-(3-methyl-[1,2,4]triazolo[3…

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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) 0.07 1.61 -25.78 2 10 0 135 380.411 5 ↓
Hi High (pH 8-9.5) 0.53 -1.02 -57.63 1 10 -1 138 379.403 5 ↓

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

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