UCSF

ZINC57910821

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2011 27 Yes

Popular Name: 2-[4-(2,2-difluoroethyl)piperazin-1-yl]-N-[(1S)-1-[4-(trifluoromethoxy)phenyl]ethyl]acetamide 2-[4-(2,2-difluoroethyl)piperazi…

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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) 3.34 3.96 -11.36 1 5 0 45 395.372 8 ↓
Lo Low (pH 4.5-6) 3.34 6.11 -39.98 2 5 1 46 396.38 8 ↓

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

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