UCSF

ZINC13570411

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 31 No

Popular Name: (4E,5R)-4-[(4-ethoxyphenyl)-hydroxy-methylene]-5-(2-pyridyl)-1-(3-pyridylmethyl)pyrrolidine-2,3-dion (4E,5R)-4-[(4-ethoxyphenyl)-hydr…

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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) 1.80 7.84 -64.83 0 7 -1 95 414.441 7 ↓
Mid Mid (pH 6-8) 1.80 7.83 -12.88 1 7 0 93 415.449 7 ↓
Mid Mid (pH 6-8) 1.22 8.22 -14.51 0 7 0 89 415.449 7 ↓

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