UCSF

ZINC06620473

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 31 No

Popular Name: 4-(hydroxy-phenyl-methylene)-5-(3-isopentyloxyphenyl)-1-(2-methoxyethyl)pyrrolidine-2,3-dione 4-(hydroxy-phenyl-methylene)-5-(…

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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) 4.05 9.52 -62.61 0 6 -1 79 422.501 10 ↓
Mid Mid (pH 6-8) 4.05 0.66 -14.02 1 6 0 76 423.509 10 ↓
Mid Mid (pH 6-8) 3.46 0.51 -11.13 0 6 0 72 423.509 10 ↓

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