UCSF

ZINC40084354

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 32 No

Popular Name: (2S)-4-hydroxy-1-(2-hydroxyethyl)-3-(4-isopropoxy-2-methyl-benzoyl)-2-(4-nitrophenyl)-2H-pyrrol-5-on (2S)-4-hydroxy-1-(2-hydroxyethyl…

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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) 2.88 7.55 -40.78 1 9 -1 136 439.444 8 ↓
Lo Low (pH 4.5-6) 2.88 6.8 -12.88 2 9 0 133 440.452 8 ↓

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