UCSF

ZINC08738695

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 32 No

Popular Name: 4-[hydroxy-(4-isopropoxyphenyl)-methylene]-1-(2-morpholinoethyl)-5-(2-thienyl)pyrrolidine-2,3-dione 4-[hydroxy-(4-isopropoxyphenyl)-…

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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) 2.95 6.49 -56.84 0 7 -1 82 455.556 8 ↓
Mid Mid (pH 6-8) 2.37 -1.96 -46.36 1 7 1 77 457.572 8 ↓
Mid Mid (pH 6-8) 2.95 8.89 -69.92 1 7 0 83 456.564 8 ↓

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