UCSF

ZINC49546442

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 29 Yes

Popular Name: 2-[6-(morpholinomethyl)-4-oxo-pyran-3-yl]oxy-N-[3-(trifluoromethyl)phenyl]acetamide 2-[6-(morpholinomethyl)-4-oxo-py…

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Download: MOL2 SDF SMILES Flexibase

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) 1.37 5.78 -30.05 1 7 0 81 412.364 7 ↓
Lo Low (pH 4.5-6) 1.37 8.08 -73.45 2 7 1 82 413.372 7 ↓

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

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