UCSF

ZINC13280577

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 13th, 2008 26 Yes

Popular Name: 3-[3-[2-[(3-fluoro-4-methyl-phenyl)methylamino]-2-oxo-ethyl]sulfanyl-5-oxo-4H-1,2,4-triazin-6-yl]pro 3-[3-[2-[(3-fluoro-4-methyl-phen…

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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) 1.50 3.54 -107.93 1 8 -2 131 378.385 8 ↓
Lo Low (pH 4.5-6) 1.04 5.03 -53.93 2 8 -1 128 379.393 8 ↓

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

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