UCSF

ZINC40100781

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 33 No

Popular Name: (2S)-3-(3-ethoxybenzoyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-2-(2-nitrophenyl)-2H-pyrrol-5-one (2S)-3-(3-ethoxybenzoyl)-4-hydro…

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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) 1.96 5.46 -61.16 1 10 -1 145 455.443 11 ↓
Lo Low (pH 4.5-6) 1.96 4.7 -14.92 2 10 0 142 456.451 11 ↓

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