UCSF

ZINC06622199

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 28 No

Popular Name: 4-[(4-fluorophenyl)-hydroxy-methylene]-1-(2-furylmethyl)-5-(5-methyl-2-furyl)-pyrrolidine-2,3-dione 4-[(4-fluorophenyl)-hydroxy-meth…

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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) 2.68 8.29 -56.01 0 6 -1 87 380.351 5 ↓
Mid Mid (pH 6-8) 2.68 2 -12.55 1 6 0 83 381.359 5 ↓
Mid Mid (pH 6-8) 2.09 1.87 -10.81 0 6 0 80 381.359 5 ↓

Activity (Go SEA)

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