UCSF

ZINC40118700

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 29 Yes

Popular Name: 4-[[[5-(4-fluorophenyl)-2-oxo-1,3,4-oxadiazol-3-yl]methyl-(2,2,2-trifluoroethyl)amino]methyl]benzoni 4-[[[5-(4-fluorophenyl)-2-oxo-1,…

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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) 3.58 7 -11.2 0 6 0 75 406.339 7 ↓
Lo Low (pH 4.5-6) 3.58 9.87 -52.86 1 6 1 76 407.347 7 ↓

Activity (Go SEA)

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