UCSF

ZINC05045096

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2006 27 No

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

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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) 0.96 3.53 -62.05 1 8 -1 112 372.353 7 ↓
Mid Mid (pH 6-8) 1.41 3.26 -34.53 2 8 0 109 373.361 6 ↓
Mid Mid (pH 6-8) 0.38 3.31 -27.57 1 8 0 106 373.361 7 ↓

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