UCSF

ZINC13280560

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2008 28 Yes

Popular Name: 3-[3-[2-[[4-bromo-3-(trifluoromethyl)phenyl]amino]-2-oxo-ethyl]sulfanyl-5-oxo-4H-1,2,4-triazin-6-yl] 3-[3-[2-[[4-bromo-3-(trifluorome…

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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) 2.89 4.22 -105.65 1 8 -2 131 479.234 8 ↓
Lo Low (pH 4.5-6) 2.43 5.7 -53.69 2 8 -1 128 480.242 8 ↓

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

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