UCSF

ZINC05045104

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2006 26 No

Popular Name: 3-hydroxy-1-(2-methoxyethyl)-4-(5-methyl-2-furoyl)-5-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one 3-hydroxy-1-(2-methoxyethyl)-4-(…

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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) 2.29 7.34 -64.37 0 6 -1 83 354.382 6 ↓
Mid Mid (pH 6-8) 1.71 7.32 -19.35 0 6 0 77 355.39 6 ↓
Mid Mid (pH 6-8) 2.74 6.29 -31.33 1 6 0 80 355.39 5 ↓

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