UCSF

ZINC17044306

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 12th, 2008 31 No

Popular Name: (4E,5R)-5-(4-fluorophenyl)-4-(hydroxy-phenyl-methylene)-1-(3-morpholinopropyl)pyrrolidine-2,3-dione (4E,5R)-5-(4-fluorophenyl)-4-(hy…

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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) 2.69 7.39 -59.39 0 6 -1 73 423.464 7 ↓
Mid Mid (pH 6-8) 2.69 9.66 -72.44 1 6 0 74 424.472 7 ↓
Lo Low (pH 4.5-6) 2.69 8.9 -48.92 2 6 1 71 425.48 7 ↓

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