UCSF

ZINC06458861

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 30th, 2006 34 No

Popular Name: 4-(7-methoxybenzofuran-2-yl)carbonyl-1-(3-methoxypropyl)-5-(4-nitrophenyl)-pyrrolidine-2,3-dione 4-(7-methoxybenzofuran-2-yl)carb…

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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) 3.17 8.54 -59.4 0 10 -1 138 465.438 9 ↓
Mid Mid (pH 6-8) 3.61 1.89 -35.88 1 10 0 135 466.446 8 ↓
Mid Mid (pH 6-8) 2.58 2.2 -21.4 0 10 0 131 466.446 9 ↓

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