UCSF

ZINC22719936

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 31 Yes

Popular Name: 2-[(6-methyl-7-oxo-8H-[1,2,4]triazolo[4,5-b][1,2,4]triazin-3-yl)sulfanyl]-N-(4-tetralin-6-ylthiazol- 2-[(6-methyl-7-oxo-8H-[1,2,4]tri…

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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) 3.29 9.76 -46.86 1 9 -1 121 452.545 5 ↓
Hi High (pH 8-9.5) 3.47 8.69 -91.35 0 9 -2 127 451.537 5 ↓

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

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