UCSF

ZINC20310471

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 34 No

Popular Name: (5R)-3-hydroxy-4-(2-hydroxy-5-methyl-benzoyl)-1-(2-morpholinoethyl)-5-(4-nitrophenyl)-5H-pyrrol-2-on (5R)-3-hydroxy-4-(2-hydroxy-5-me…

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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) 2.58 6.6 -53.09 1 10 -1 139 466.47 7 ↓
Hi High (pH 8-9.5) 2.58 7.45 -126.86 0 10 -2 142 465.462 7 ↓
Mid Mid (pH 6-8) 2.58 8.94 -69.03 2 10 0 140 467.478 7 ↓

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